methyl 2-chloro-5-({1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-({1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
methyl 2-chloro-5-({1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | D356-0646 |
| Compound Name: | methyl 2-chloro-5-({1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carbonyl}amino)benzoate |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C22 H25 Cl N2 O5 S |
| Smiles: | Cc1ccccc1CS(N1CCC(CC1)C(Nc1ccc(c(c1)C(=O)OC)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0342 |
| logD: | 4.0321 |
| logSw: | -4.4016 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.109 |
| InChI Key: | JOWDIQMRWKHDPW-UHFFFAOYSA-N |