methyl 2-chloro-5-({1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-({1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
methyl 2-chloro-5-({1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | D356-0865 |
| Compound Name: | methyl 2-chloro-5-({1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C22 H25 Cl N2 O5 S |
| Smiles: | Cc1cccc(CS(N2CCC(CC2)C(Nc2ccc(c(c2)C(=O)OC)[Cl])=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9587 |
| logD: | 3.9565 |
| logSw: | -4.3141 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.109 |
| InChI Key: | DRBSLZDJLAZICV-UHFFFAOYSA-N |