ethyl 4-(2-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-6003 |
| Compound Name: | ethyl 4-(2-chlorophenyl)-6-{[4-(ethoxycarbonyl)piperidin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 490 |
| Molecular Formula: | C25 H32 Cl N3 O5 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)CC1=C(C(c2ccccc2[Cl])NC(N1CC=C)=O)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8535 |
| logD: | 0.6281 |
| logSw: | -4.1305 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.489 |
| InChI Key: | BCSAFYKURYHOSV-QFIPXVFZSA-N |