ethyl 1-ethyl-6-{[4-(methoxyacetyl)piperazin-1-yl]methyl}-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-6-{[4-(methoxyacetyl)piperazin-1-yl]methyl}-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-6-{[4-(methoxyacetyl)piperazin-1-yl]methyl}-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-2520 |
| Compound Name: | ethyl 1-ethyl-6-{[4-(methoxyacetyl)piperazin-1-yl]methyl}-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 512.53 |
| Molecular Formula: | C24 H31 F3 N4 O5 |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCN(CC2)C(COC)=O)=C(C(c2ccccc2C(F)(F)F)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9159 |
| logD: | 1.292 |
| logSw: | -2.7111 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.106 |
| InChI Key: | MDZPVFXIRKOHEW-NRFANRHFSA-N |