ethyl 4-(3-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V016-3806 |
| Compound Name: | ethyl 4-(3-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 463.96 |
| Molecular Formula: | C23 H30 Cl N3 O5 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)CC1=C(C(c2cccc(c2)[Cl])NC(N1C)=O)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1168 |
| logD: | -0.3585 |
| logSw: | -3.5747 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.276 |
| InChI Key: | HMNKNSHAIFKXEJ-FQEVSTJZSA-N |