ethyl 1-ethyl-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V019-3777 |
| Compound Name: | ethyl 1-ethyl-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 558.6 |
| Molecular Formula: | C29 H33 F3 N4 O4 |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCN(CC2)C(c2ccc(C)cc2)=O)=C(C(c2ccc(cc2)C(F)(F)F)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0946 |
| logD: | 3.649 |
| logSw: | -3.9225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.938 |
| InChI Key: | YHODMSRTIJNJKD-VWLOTQADSA-N |