Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H13ClN4 |
Molecular Weight | 248.711 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCC1=C(C(N)=NC(N)=N1)C2=CC=C(Cl)C=C2
InChI
InChIKey=WKSAUQYGYAYLPV-UHFFFAOYSA-N
InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)
Molecular Formula | C12H13ClN4 |
Molecular Weight | 248.711 |
Charge | 0 |
Count |
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Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:21:23 UTC 2023
by
admin
on
Fri Dec 15 15:21:23 UTC 2023
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Record UNII |
Z3614QOX8W
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Record Status |
Validated (UNII)
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Record Version |
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Classification Tree | Code System | Code | ||
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LIVERTOX |
NBK548044
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NDF-RT |
N0000000191
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NDF-RT |
N0000000191
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WHO-ATC |
P01BD51
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NDF-RT |
N0000175934
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WHO-ESSENTIAL MEDICINES LIST |
6.5.3.1 (SUL/PYR)
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FDA ORPHAN DRUG |
232206
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EPA PESTICIDE CODE |
600071
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WHO-ESSENTIAL MEDICINES LIST |
6.5.4
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IARC | Pyrimethamine | ||
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NCI_THESAURUS |
C271
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NCI_THESAURUS |
C2153
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WHO-ATC |
P01BF04
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CFR |
21 CFR 520.2215
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WHO-VATC |
QP51AX51
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WHO-ATC |
P01BD01
Created by
admin on Fri Dec 15 15:21:23 UTC 2023 , Edited by admin on Fri Dec 15 15:21:23 UTC 2023
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Code System | Code | Type | Description | ||
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m9368
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PRIMARY | Merck Index | ||
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D011739
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Z3614QOX8W
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1589007
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4993
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CHEMBL36
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PYRIMETHAMINE
Created by
admin on Fri Dec 15 15:21:23 UTC 2023 , Edited by admin on Fri Dec 15 15:21:23 UTC 2023
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PRIMARY | Description: A white, crystalline powder; odourless. Solubility: Practically insoluble in water; slightly soluble in ethanol (~750 g/l) TS and acetone R. Category: Antimalarial. Storage: Pyrimethamine should be kept in a well-closed container, protected from light. Definition: Pyrimethamine contains not less than 99.0% and not more than 101.0% of C12H13ClN4, calculated with reference to the dried substance. | ||
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PYRIMETHAMINE
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PRIMARY | |||
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2215
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PRIMARY | |||
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9010
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PRIMARY | RxNorm | ||
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58-14-0
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PRIMARY | |||
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8673
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4800
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DB00205
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Z3614QOX8W
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SUB10169MIG
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PRIMARY | |||
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C788
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3061
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DTXSID9021217
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100000080868
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200-364-2
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Pyrimethamine
Created by
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Sulfadoxine and Pyrimethamine
Created by
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2332
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8042
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PRIMARY |
Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT | |||
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TARGET -> INHIBITOR | |||
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SALT/SOLVATE -> PARENT |
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BINDER->LIGAND |
BINDING
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Biological Half-life | PHARMACOKINETIC |
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