methyl 2-({1-[(4-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({1-[(4-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
methyl 2-({1-[(4-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | D356-0953 |
| Compound Name: | methyl 2-({1-[(4-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C22 H26 N2 O5 S |
| Smiles: | Cc1ccc(CS(N2CCC(CC2)C(Nc2ccccc2C(=O)OC)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7922 |
| logD: | 2.7239 |
| logSw: | -3.4732 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.411 |
| InChI Key: | VKXDKRTYPACQFE-UHFFFAOYSA-N |