3-{[2-(methoxycarbonyl)thiophene-3-sulfonyl]amino}benzoic acid
Chemical Structure Depiction of
3-{[2-(methoxycarbonyl)thiophene-3-sulfonyl]amino}benzoic acid
3-{[2-(methoxycarbonyl)thiophene-3-sulfonyl]amino}benzoic acid
Compound characteristics
| Compound ID: | Y600-4498 |
| Compound Name: | 3-{[2-(methoxycarbonyl)thiophene-3-sulfonyl]amino}benzoic acid |
| Molecular Weight: | 341.36 |
| Molecular Formula: | C13 H11 N O6 S2 |
| Smiles: | COC(c1c(ccs1)S(Nc1cccc(c1)C(O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6515 |
| logD: | -0.0987 |
| logSw: | -3.0407 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.488 |
| InChI Key: | JUYPNIPDNHRJJH-UHFFFAOYSA-N |