4-bromo-2-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-2-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
4-bromo-2-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | F555-0035 |
| Compound Name: | 4-bromo-2-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]benzene-1-sulfonamide |
| Molecular Weight: | 451.34 |
| Molecular Formula: | C19 H19 Br N2 O4 S |
| Smiles: | CCCNC1=C(C(=O)Oc2ccccc12)NS(c1ccc(cc1C)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8307 |
| logD: | -1.9286 |
| logSw: | -3.9988 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.555 |
| InChI Key: | CYIVSJSGABSTOX-UHFFFAOYSA-N |