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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H31FN4O4
Molecular Weight 482.5471
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CP-481715

SMILES

CC(C)(O)CC[C@H](C[C@H](O)[C@H](CC1=CC=CC(F)=C1)NC(=O)C2=NC3=CC=CC=C3N=C2)C(N)=O

InChI

InChIKey=YEQJVHQCUDMXFG-FHZYATBESA-N
InChI=1S/C26H31FN4O4/c1-26(2,35)11-10-17(24(28)33)14-23(32)21(13-16-6-5-7-18(27)12-16)31-25(34)22-15-29-19-8-3-4-9-20(19)30-22/h3-9,12,15,17,21,23,32,35H,10-11,13-14H2,1-2H3,(H2,28,33)(H,31,34)/t17-,21+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C26H31FN4O4
Molecular Weight 482.5471
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
CP-481,715, a potent and selective CCR1 antagonist with potential therapeutic implications for inflammatory diseases.
2003 Oct 17
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:40:40 GMT 2023
Edited
by admin
on Fri Dec 15 15:40:40 GMT 2023
Record UNII
X3TDA066ME
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CP-481715
Common Name English
2-QUINOXALINECARBOXAMIDE, N-((1S,2S,4R)-4-(AMINOCARBONYL)-1-((3-FLUOROPHENYL)METHYL)-2,7-DIHYDROXY-7-METHYLOCTYL)-
Systematic Name English
Code System Code Type Description
CAS
212790-31-3
Created by admin on Fri Dec 15 15:40:40 GMT 2023 , Edited by admin on Fri Dec 15 15:40:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID00175540
Created by admin on Fri Dec 15 15:40:40 GMT 2023 , Edited by admin on Fri Dec 15 15:40:40 GMT 2023
PRIMARY
FDA UNII
X3TDA066ME
Created by admin on Fri Dec 15 15:40:40 GMT 2023 , Edited by admin on Fri Dec 15 15:40:40 GMT 2023
PRIMARY
PUBCHEM
5311123
Created by admin on Fri Dec 15 15:40:40 GMT 2023 , Edited by admin on Fri Dec 15 15:40:40 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY