ethyl 4-(2,3-dimethoxyphenyl)-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,3-dimethoxyphenyl)-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,3-dimethoxyphenyl)-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V021-5652 |
| Compound Name: | ethyl 4-(2,3-dimethoxyphenyl)-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 540.59 |
| Molecular Formula: | C28 H33 F N4 O6 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2cccc(c2OC)OC)NC(N(C)C=1CN1CCN(CC1)C(c1ccc(cc1)F)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2163 |
| logD: | 1.6848 |
| logSw: | -2.8477 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.326 |
| InChI Key: | JLGRGHCNBONAQZ-XMMPIXPASA-N |