N-(2H-1,3-benzodioxol-5-yl)-5-(4-methylbenzene-1-sulfonyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-(4-methylbenzene-1-sulfonyl)thiophene-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-(4-methylbenzene-1-sulfonyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | L796-0530 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-(4-methylbenzene-1-sulfonyl)thiophene-2-carboxamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C19 H15 N O5 S2 |
| Smiles: | Cc1ccc(cc1)S(c1ccc(C(Nc2ccc3c(c2)OCO3)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3496 |
| logD: | 4.3486 |
| logSw: | -4.3393 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.964 |
| InChI Key: | ROPMVFZNTWSDCS-UHFFFAOYSA-N |