ethyl 4-(2,3-dimethoxyphenyl)-1-ethyl-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}piperazin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,3-dimethoxyphenyl)-1-ethyl-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}piperazin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,3-dimethoxyphenyl)-1-ethyl-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}piperazin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V028-2355 |
| Compound Name: | ethyl 4-(2,3-dimethoxyphenyl)-1-ethyl-2-oxo-6-[(4-{[4-(trifluoromethyl)phenyl]carbamoyl}piperazin-1-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 619.64 |
| Molecular Formula: | C30 H36 F3 N5 O6 |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCN(CC2)C(Nc2ccc(cc2)C(F)(F)F)=O)=C(C(c2cccc(c2OC)OC)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9968 |
| logD: | 2.3282 |
| logSw: | -4.1328 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.106 |
| InChI Key: | AXHHPPVPDBOKRM-RUZDIDTESA-N |