4-bromo-2-methyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-2-methyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
4-bromo-2-methyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | F555-0088 |
| Compound Name: | 4-bromo-2-methyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide |
| Molecular Weight: | 463.35 |
| Molecular Formula: | C20 H19 Br N2 O4 S |
| Smiles: | Cc1cc(ccc1S(NC1=C(c2ccccc2OC1=O)N1CCCC1)(=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.339 |
| logD: | -1.9381 |
| logSw: | -4.2588 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.745 |
| InChI Key: | GDUPBTSHLCMAIG-UHFFFAOYSA-N |