methyl 4-{[1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carbonyl]amino}benzoate
methyl 4-{[1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | Y050-0457 |
| Compound Name: | methyl 4-{[1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C22 H26 N2 O6 S |
| Smiles: | Cc1cc(ccc1OC)S(N1CCCC(C1)C(Nc1ccc(cc1)C(=O)OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2067 |
| logD: | 3.2049 |
| logSw: | -3.5814 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.778 |
| InChI Key: | NIJNFADUQAGAHW-KRWDZBQOSA-N |