6-bromo-N-[4-(4-methylpiperazine-1-sulfonyl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-[4-(4-methylpiperazine-1-sulfonyl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-N-[4-(4-methylpiperazine-1-sulfonyl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 6353-0418 |
| Compound Name: | 6-bromo-N-[4-(4-methylpiperazine-1-sulfonyl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 506.37 |
| Molecular Formula: | C21 H20 Br N3 O5 S |
| Smiles: | CN1CCN(CC1)S(c1ccc(cc1)NC(C1=Cc2cc(ccc2OC1=O)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6187 |
| logD: | 2.2845 |
| logSw: | -3.2925 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.439 |
| InChI Key: | KFGNKCMMWWTJAZ-UHFFFAOYSA-N |