5-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
5-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide
5-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | F555-0058 |
| Compound Name: | 5-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 455.35 |
| Molecular Formula: | C17 H15 Br N2 O4 S2 |
| Smiles: | C1CCN(C1)C1=C(C(=O)Oc2ccccc12)NS(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8092 |
| logD: | -0.7503 |
| logSw: | -4.0472 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.764 |
| InChI Key: | FRGQBFQYSUKQPG-UHFFFAOYSA-N |