ethyl 6-{[4-(2-chlorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-{[4-(2-chlorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-{[4-(2-chlorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-1586 |
| Compound Name: | ethyl 6-{[4-(2-chlorobenzoyl)piperazin-1-yl]methyl}-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 589.09 |
| Molecular Formula: | C32 H33 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2cccc(c2)Oc2ccccc2)NC(N(C)C=1CN1CCN(CC1)C(c1ccccc1[Cl])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3774 |
| logD: | 3.8459 |
| logSw: | -4.5536 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.727 |
| InChI Key: | UPOVXCYRFHCAFI-GDLZYMKVSA-N |