methyl 2-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate
methyl 2-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 5641-1627 |
| Compound Name: | methyl 2-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(Nc1ccccc1C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1928 |
| logD: | 3.1245 |
| logSw: | -3.5501 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.517 |
| InChI Key: | BDQIPJPKKPAGLQ-UHFFFAOYSA-N |