ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}-1,4-diazepan-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Chemical Structure Depiction of
ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}-1,4-diazepan-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Available: 43 mg
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mg
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Compound characteristics

Compound ID: V013-0297
Compound Name: ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}-1,4-diazepan-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Molecular Weight: 603.64
Molecular Formula: C30 H36 F3 N5 O5
Salt: not_available
Smiles: CCN1C(CN2CCCN(CC2)C(Nc2ccc(cc2)C(F)(F)F)=O)=C(C(c2ccccc2OC)NC1=O)C(=O)OCC
Stereo: RACEMIC MIXTURE
logP: 4.5358
logD: 1.3866
logSw: -4.0745
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 2
Polar surface area: 85.72
InChI Key: OTHWAAQRYSAXOC-AREMUKBSSA-N
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