methyl 4-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
methyl 4-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D356-0057 |
| Compound Name: | methyl 4-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 408.49 |
| Molecular Formula: | C18 H20 N2 O5 S2 |
| Smiles: | COC(c1ccc(cc1)NC(C1CCN(CC1)S(c1cccs1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4434 |
| logD: | 2.443 |
| logSw: | -2.7945 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.233 |
| InChI Key: | AJKFBLFMELCPIW-UHFFFAOYSA-N |