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Details

Stereochemistry MIXED
Molecular Formula C23H25ClN2O.ClH
Molecular Weight 417.371
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OPAGANIB HYDROCHLORIDE

SMILES

Cl.ClC1=CC=C(C=C1)C23CC4CC(CC(C4)(C2)C(=O)NCC5=CC=NC=C5)C3

InChI

InChIKey=BXGLNXNRKRUYTH-UHFFFAOYSA-N
InChI=1S/C23H25ClN2O.ClH/c24-20-3-1-19(2-4-20)22-10-17-9-18(11-22)13-23(12-17,15-22)21(27)26-14-16-5-7-25-8-6-16;/h1-8,17-18H,9-15H2,(H,26,27);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 C23H25ClN2O
Molecular Weight 380.91
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:41:31 UTC 2023
Edited
by admin
on Fri Dec 15 19:41:31 UTC 2023
Record UNII
RFN6U0F30B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OPAGANIB HYDROCHLORIDE
Common Name English
ABC-294640 HYDROCHLORIDE
Common Name English
ABC-294640 HCL
Common Name English
TRICYCLO(3.3.1.13,7)DECANE-1-CARBOXAMIDE, 3-(4-CHLOROPHENYL)-N-(4-PYRIDINYLMETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
OPAGANIB HCL
Common Name English
Code System Code Type Description
FDA UNII
RFN6U0F30B
Created by admin on Fri Dec 15 19:41:32 UTC 2023 , Edited by admin on Fri Dec 15 19:41:32 UTC 2023
PRIMARY
PUBCHEM
73438894
Created by admin on Fri Dec 15 19:41:32 UTC 2023 , Edited by admin on Fri Dec 15 19:41:32 UTC 2023
PRIMARY
CAS
1185157-59-8
Created by admin on Fri Dec 15 19:41:32 UTC 2023 , Edited by admin on Fri Dec 15 19:41:32 UTC 2023
PRIMARY
SMS_ID
300000021746
Created by admin on Fri Dec 15 19:41:32 UTC 2023 , Edited by admin on Fri Dec 15 19:41:32 UTC 2023
PRIMARY
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