CHEMBL176492 structure

CHEMBL176492

1-[4-[4-[4-[[(2R,4S)-4-(2,4-difluorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-3-propan-2-ylimidazolidin-2-one

Also Known As: R-126638|2-Imidazolidinone, 1-[4-[4-[4-[[(2R,4S)-4-(2,4-difluorophenyl)-4-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-3-(1-methylethyl)-

CAS: 219923-84-9
Molecular Formula C35H39F2N7O4
Molecular Weight 659.30316 g/mol
LogP 4.8807
Topological Polar Surface Area 88.43 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 10
Exact Mass 659.30316
Monoisotopic Mass 659.30316
Heavy Atoms 48
Complexity 1699.1149

Chemical Identifiers

CAS Number 219923-84-9
SMILES CC(C)N1CCN(C1=O)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC[C@@H]5OC[C@@](O5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F

Product Overview

CHEMBL176492 (CAS 219923-84-9), with molecular formula C35H39F2N7O4 and molecular weight 659.30316 g/mol. IUPAC: 1-[4-[4-[4-[[(2R,4S)-4-(2,4-difluorophenyl)-4-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-3-propan-2-ylimidazolidin-2-one.

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