N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-4-nitrobenzene-1-sulfonamide
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | C301-4120 |
| Compound Name: | N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 375.36 |
| Molecular Formula: | C16 H13 N3 O6 S |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NS(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7376 |
| logD: | -4.0329 |
| logSw: | -2.7094 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.246 |
| InChI Key: | SLFGBJHMAQQWKG-UHFFFAOYSA-N |