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Details

Stereochemistry ACHIRAL
Molecular Formula C25H20F4N4O3S.ClH
Molecular Weight 568.971
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DPC-423

SMILES

Cl.CS(=O)(=O)C1=CC=CC=C1C2=CC=C(NC(=O)C3=CC(=NN3C4=CC=CC(CN)=C4)C(F)(F)F)C(F)=C2

InChI

InChIKey=LJBVKRYJJZQKGE-UHFFFAOYSA-N
InChI=1S/C25H20F4N4O3S.ClH/c1-37(35,36)22-8-3-2-7-18(22)16-9-10-20(19(26)12-16)31-24(34)21-13-23(25(27,28)29)32-33(21)17-6-4-5-15(11-17)14-30;/h2-13H,14,30H2,1H3,(H,31,34);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 C25H20F4N4O3S
Molecular Weight 532.51
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
The design and synthesis of noncovalent factor Xa inhibitors.
2001 Jun
Substance Class Chemical
Created
by admin
on Sat Dec 16 18:58:46 GMT 2023
Edited
by admin
on Sat Dec 16 18:58:46 GMT 2023
Record UNII
3XLJ2DL48G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DPC-423
Code English
1H-PYRAZOLE-5-CARBOXAMIDE, 1-(3-(AMINOMETHYL)PHENYL)-N-(3-FLUORO-2'-(METHYLSULFONYL)(1,1'-BIPHENYL)-4-YL)-3-(TRIFLUOROMETHYL)-, MONOHYDROCHLORIDE
Systematic Name English
DPC423
Code English
1H-PYRAZOLE-5-CARBOXAMIDE, 1-(3-(AMINOMETHYL)PHENYL)-N-(3-FLUORO-2'-(METHYLSULFONYL)(1,1'-BIPHENYL)-4-YL)-3-(TRIFLUOROMETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
1-(3-(AMINOMETHYL)PHENYL)-N-(3-FLUORO-2'-METHANESULFONYL-(1,1'-BIPHENYL)-4-YL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOXAMIDE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
9937921
Created by admin on Sat Dec 16 18:58:46 GMT 2023 , Edited by admin on Sat Dec 16 18:58:46 GMT 2023
PRIMARY
CAS
292135-59-2
Created by admin on Sat Dec 16 18:58:46 GMT 2023 , Edited by admin on Sat Dec 16 18:58:46 GMT 2023
PRIMARY
FDA UNII
3XLJ2DL48G
Created by admin on Sat Dec 16 18:58:46 GMT 2023 , Edited by admin on Sat Dec 16 18:58:46 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY