Cp-609754
6-[(R)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(3-ethynylphenyl)-1-methylquinolin-2-one
Molecular Identity
Cp-609754
6-[(R)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(3-ethynylphenyl)-1-methylquinolin-2-one
PubChem CID: 46208720
2D Structure
Properties
C29H22ClN3O2
Molecular Formula
480.00
Molecular Weight
g/mol
479.1401
Exact Mass
Da
4
XLogP
Drug-like (Lipinski: < 5)
58.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
874
Complexity
SMILES
Canonical SMILES
SMILES: CN1C=NC=C1C(C2=CC=C(C=C2)Cl)(C3=CC4=C(C=C3)N(C(=O)C=C4C5=CC=CC(=C5)C#C)C)OIsomeric SMILES
SMILES: CN1C=NC=C1[C@@](C2=CC=C(C=C2)Cl)(C3=CC4=C(C=C3)N(C(=O)C=C4C5=CC=CC(=C5)C#C)C)OSynonyms(20)
CP-6097541190094-64-4OSI-754L0S47W9GPYCP-609,754DTXSID40152294RefChem:128330DTXCID3074785CP609754CP 609,7546-((R)-(4-chlorophenyl)(hydroxy)(1-methyl-1H-imidazol-5-yl)methyl)-4-(3-ethynylphenyl)-1-methyl-1,2-dihydroquinolin-2-oneCP 609754UNII-L0S47W9GPYLNK-754(R)-6-((4-chlorophenyl)(hydroxy)(1-methyl-1H-imidazol-5-yl)methyl)-4-(3-ethynylphenyl)-1-methylquinolin-2(1H)-one
Data from PubChem (NCBI)
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Drug Network
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