ethyl 4-(3-fluorophenyl)-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-fluorophenyl)-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3-fluorophenyl)-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V015-9433 |
| Compound Name: | ethyl 4-(3-fluorophenyl)-6-{[4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 520.6 |
| Molecular Formula: | C29 H33 F N4 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2cccc(c2)F)NC(N(CC=C)C=1CN1CCN(CC1)C(c1ccc(C)cc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5924 |
| logD: | 3.2214 |
| logSw: | -3.59 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.191 |
| InChI Key: | JMDSPPMMZWGCHA-SANMLTNESA-N |