methyl 2-{[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino}benzoate
methyl 2-{[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | Y205-2335 |
| Compound Name: | methyl 2-{[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 408.28 |
| Molecular Formula: | C19 H19 Cl2 N3 O3 |
| Smiles: | COC(c1ccccc1NC(N1CCN(CC1)c1ccc(c(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5012 |
| logD: | 4.5004 |
| logSw: | -4.5555 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.444 |
| InChI Key: | HCDKAUZYRSXPBQ-UHFFFAOYSA-N |