N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-2-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-2-nitrobenzene-1-sulfonamide
N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-2-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | C301-4537 |
| Compound Name: | N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-2-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 389.38 |
| Molecular Formula: | C17 H15 N3 O6 S |
| Smiles: | CCNC1=C(C(=O)Oc2ccccc12)NS(c1ccccc1[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7029 |
| logD: | -3.28 |
| logSw: | -2.7215 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.42 |
| InChI Key: | JJKCUDHCQFKKAH-UHFFFAOYSA-N |