2-[(6-{[(4-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(6-{[(4-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
2-[(6-{[(4-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 8004-9109 |
| Compound Name: | 2-[(6-{[(4-fluorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(3-nitrophenyl)acetamide |
| Molecular Weight: | 466.51 |
| Molecular Formula: | C22 H15 F N4 O3 S2 |
| Smiles: | C(C(Nc1cccc(c1)[N+]([O-])=O)=O)Sc1nc2ccc(cc2s1)/N=C/c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.3526 |
| logD: | 5.3516 |
| logSw: | -5.7232 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.707 |
| InChI Key: | DVYHLVYEWUXONN-UHFFFAOYSA-N |