N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}-2-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}-2-(4-fluorophenyl)acetamide
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}-2-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | Y500-0165 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-5-nitrophenyl}-2-(4-fluorophenyl)acetamide |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C21 H14 F N3 O3 S2 |
| Smiles: | C(C(Nc1cc(cc(c1)Sc1nc2ccccc2s1)[N+]([O-])=O)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.7397 |
| logD: | 5.739 |
| logSw: | -5.8001 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.308 |
| InChI Key: | KUAFFTQTBHPBSD-UHFFFAOYSA-N |