methyl 2-({4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}amino)benzoate
methyl 2-({4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | Y206-3688 |
| Compound Name: | methyl 2-({4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C21 H25 N3 O3 |
| Smiles: | Cc1ccc(CN2CCN(CC2)C(Nc2ccccc2C(=O)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3226 |
| logD: | 2.6994 |
| logSw: | -3.6024 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.724 |
| InChI Key: | GQGNJYHLZNXJQB-UHFFFAOYSA-N |