ethyl 4-(3-fluorophenyl)-1-methyl-2-oxo-6-({4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-fluorophenyl)-1-methyl-2-oxo-6-({4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3-fluorophenyl)-1-methyl-2-oxo-6-({4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-3258 |
| Compound Name: | ethyl 4-(3-fluorophenyl)-1-methyl-2-oxo-6-({4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 548.54 |
| Molecular Formula: | C27 H28 F4 N4 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2cccc(c2)F)NC(N(C)C=1CN1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2794 |
| logD: | 2.7479 |
| logSw: | -3.4297 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.979 |
| InChI Key: | ZYONVNIUPGYHPH-QHCPKHFHSA-N |