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ethyl 4-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Chemical Structure Depiction of
ethyl 4-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Available: 3 mg
Amount:
mg
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$83.09
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Compound characteristics

Compound ID: Y500-6759
Compound Name: ethyl 4-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Molecular Weight: 564.51
Molecular Formula: C31 H31 Cl2 N3 O3
Smiles: CCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1cn(Cc2ccc(cc2[Cl])[Cl])nc1c1ccccc1)=O
Stereo: RACEMIC MIXTURE
logP: 6.7239
logD: 2.5162
logSw: -6.2395
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 59.456
InChI Key: WGCGFJBJVVMPGW-MHZLTWQESA-N
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