{2-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}(phenyl)methanone
Chemical Structure Depiction of
{2-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}(phenyl)methanone
{2-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}(phenyl)methanone
Compound characteristics
| Compound ID: | 8016-2200 |
| Compound Name: | {2-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}(phenyl)methanone |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C20 H12 N2 O3 S2 |
| Smiles: | c1ccc(cc1)C(c1cc(ccc1Sc1nc2ccccc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9959 |
| logD: | 5.9959 |
| logSw: | -5.992 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.897 |
| InChI Key: | XTKFUSLGVHGLJS-UHFFFAOYSA-N |