methyl 4-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate
methyl 4-{[1-(4-methylbenzene-1-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 6065-0219 |
| Compound Name: | methyl 4-{[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(Nc1ccc(cc1)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2604 |
| logD: | 3.2599 |
| logSw: | -3.4282 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.214 |
| InChI Key: | KIAFNOVOWVARQS-UHFFFAOYSA-N |