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Details

Stereochemistry ACHIRAL
Molecular Formula C23H23FN4O2.ClH
Molecular Weight 442.914
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VENADAPARIB HYDROCHLORIDE

SMILES

Cl.FC1=C(C=C(CC2=NNC(=O)C3=CC=CC=C23)C=C1)C(=O)N4CC(CNC5CC5)C4

InChI

InChIKey=FSVSACOGQQIXAF-UHFFFAOYSA-N
InChI=1S/C23H23FN4O2.ClH/c24-20-8-5-14(10-21-17-3-1-2-4-18(17)22(29)27-26-21)9-19(20)23(30)28-12-15(13-28)11-25-16-6-7-16;/h1-5,8-9,15-16,25H,6-7,10-13H2,(H,27,29);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 C23H23FN4O2
Molecular Weight 406.4527
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 16:34:17 UTC 2023
Edited
by admin
on Sat Dec 16 16:34:17 UTC 2023
Record UNII
ZJ8S8D3DK3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VENADAPARIB HYDROCHLORIDE
INN  
Common Name English
1(2H)-PHTHALAZINONE, 4-((3-((3-((CYCLOPROPYLAMINO)METHYL)-1-AZETIDINYL)CARBONYL)-4-FLUOROPHENYL)METHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
4-((3-((3-((CYCLOPROPYLAMINO)METHYL)-1-AZETIDINYL)CARBONYL)-4-FLUOROPHENYL)METHYL)-1(2H)-PHTHALAZINONE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
CAS
1681020-60-9
Created by admin on Sat Dec 16 16:34:17 UTC 2023 , Edited by admin on Sat Dec 16 16:34:17 UTC 2023
PRIMARY
PUBCHEM
117955897
Created by admin on Sat Dec 16 16:34:17 UTC 2023 , Edited by admin on Sat Dec 16 16:34:17 UTC 2023
PRIMARY
FDA UNII
ZJ8S8D3DK3
Created by admin on Sat Dec 16 16:34:17 UTC 2023 , Edited by admin on Sat Dec 16 16:34:17 UTC 2023
PRIMARY
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