methyl 4,5-dimethoxy-2-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4,5-dimethoxy-2-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
methyl 4,5-dimethoxy-2-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D356-0216 |
| Compound Name: | methyl 4,5-dimethoxy-2-{[1-(thiophene-2-sulfonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C20 H24 N2 O7 S2 |
| Smiles: | COC(c1cc(c(cc1NC(C1CCN(CC1)S(c1cccs1)(=O)=O)=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0514 |
| logD: | 1.4062 |
| logSw: | -3.0212 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.796 |
| InChI Key: | YNEWBIRWOXXOSB-UHFFFAOYSA-N |