methyl 3-({4-[2-(4-chlorophenyl)-2-{[4-(methoxycarbonyl)phenyl]methoxy}ethyl]piperazine-1-carbonyl}amino)-2-methylbenzoate
Chemical Structure Depiction of
methyl 3-({4-[2-(4-chlorophenyl)-2-{[4-(methoxycarbonyl)phenyl]methoxy}ethyl]piperazine-1-carbonyl}amino)-2-methylbenzoate
methyl 3-({4-[2-(4-chlorophenyl)-2-{[4-(methoxycarbonyl)phenyl]methoxy}ethyl]piperazine-1-carbonyl}amino)-2-methylbenzoate
Compound characteristics
| Compound ID: | V002-0055 |
| Compound Name: | methyl 3-({4-[2-(4-chlorophenyl)-2-{[4-(methoxycarbonyl)phenyl]methoxy}ethyl]piperazine-1-carbonyl}amino)-2-methylbenzoate |
| Molecular Weight: | 580.08 |
| Molecular Formula: | C31 H34 Cl N3 O6 |
| Salt: | not_available |
| Smiles: | Cc1c(cccc1NC(N1CCN(CC1)CC(c1ccc(cc1)[Cl])OCc1ccc(cc1)C(=O)OC)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2759 |
| logD: | 5.2105 |
| logSw: | -5.8843 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.778 |
| InChI Key: | FRLDISFIGKGDAW-NDEPHWFRSA-N |