5-bromo-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
5-bromo-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide
5-bromo-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | C301-4181 |
| Compound Name: | 5-bromo-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 415.28 |
| Molecular Formula: | C14 H11 Br N2 O4 S2 |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NS(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4972 |
| logD: | -1.5653 |
| logSw: | -3.014 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.883 |
| InChI Key: | OHKPEFIFRQBZAL-UHFFFAOYSA-N |