3-[(4-chlorophenyl)sulfanyl]-6-nitro-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)sulfanyl]-6-nitro-4-phenylquinolin-2(1H)-one
3-[(4-chlorophenyl)sulfanyl]-6-nitro-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 5236-0095 |
| Compound Name: | 3-[(4-chlorophenyl)sulfanyl]-6-nitro-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 408.86 |
| Molecular Formula: | C21 H13 Cl N2 O3 S |
| Smiles: | c1ccc(cc1)C1=C(C(Nc2ccc(cc12)[N+]([O-])=O)=O)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7847 |
| logD: | 5.7835 |
| logSw: | -6.0031 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.954 |
| InChI Key: | SXJQTJLPIXCEAP-UHFFFAOYSA-N |