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Details

Stereochemistry ACHIRAL
Molecular Formula C25H21N5O.2ClH
Molecular Weight 480.389
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-2206 DIHYDROCHLORIDE

SMILES

Cl.Cl.NC1(CCC1)C2=CC=C(C=C2)C3=C(C=C4C5=NNC(=O)N5C=CC4=N3)C6=CC=CC=C6

InChI

InChIKey=HWUHTJIKQZZBRA-UHFFFAOYSA-N
InChI=1S/C25H21N5O.2ClH/c26-25(12-4-13-25)18-9-7-17(8-10-18)22-19(16-5-2-1-3-6-16)15-20-21(27-22)11-14-30-23(20)28-29-24(30)31;;/h1-3,5-11,14-15H,4,12-13,26H2,(H,29,31);2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C25H21N5O
Molecular Weight 407.4671
Charge 0
Count
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 Sat Dec 16 09:08:58 UTC 2023
Edited
by admin
on Sat Dec 16 09:08:58 UTC 2023
Record UNII
Q34I3E28IO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MK-2206 DIHYDROCHLORIDE
Common Name English
1,2,4-TRIAZOLO(3,4-F)(1,6)NAPHTHYRIDIN-3(2H)-ONE, 8-(4-(1-AMINOCYCLOBUTYL)PHENYL)-9-PHENYL-, HYDROCHLORIDE (1:2)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID3048948
Created by admin on Sat Dec 16 09:08:58 UTC 2023 , Edited by admin on Sat Dec 16 09:08:58 UTC 2023
PRIMARY
FDA UNII
Q34I3E28IO
Created by admin on Sat Dec 16 09:08:58 UTC 2023 , Edited by admin on Sat Dec 16 09:08:58 UTC 2023
PRIMARY
PUBCHEM
46930998
Created by admin on Sat Dec 16 09:08:58 UTC 2023 , Edited by admin on Sat Dec 16 09:08:58 UTC 2023
PRIMARY
CAS
1032350-13-2
Created by admin on Sat Dec 16 09:08:58 UTC 2023 , Edited by admin on Sat Dec 16 09:08:58 UTC 2023
PRIMARY
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