methyl 4-methyl-3-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-methyl-3-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
methyl 4-methyl-3-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D356-0120 |
| Compound Name: | methyl 4-methyl-3-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C19 H22 N2 O5 S2 |
| Smiles: | Cc1ccc(cc1NC(C1CCN(CC1)S(c1cccs1)(=O)=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7039 |
| logD: | 2.7039 |
| logSw: | -3.0965 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.535 |
| InChI Key: | XAJVNDCFBMPORC-UHFFFAOYSA-N |