methyl 4-{[1-(4-chlorophenyl)-2-(4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}piperazin-1-yl)ethoxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(4-chlorophenyl)-2-(4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}piperazin-1-yl)ethoxy]methyl}benzoate
methyl 4-{[1-(4-chlorophenyl)-2-(4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}piperazin-1-yl)ethoxy]methyl}benzoate
Compound characteristics
| Compound ID: | V006-2685 |
| Compound Name: | methyl 4-{[1-(4-chlorophenyl)-2-(4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}piperazin-1-yl)ethoxy]methyl}benzoate |
| Molecular Weight: | 580.08 |
| Molecular Formula: | C31 H34 Cl N3 O6 |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCN(CC1)CC(c1ccc(cc1)[Cl])OCc1ccc(cc1)C(=O)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4904 |
| logD: | 5.4251 |
| logSw: | -6.207 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.056 |
| InChI Key: | RFNGDLKLIUEDIG-NDEPHWFRSA-N |