2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | 8007-1958 |
| Compound Name: | 2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C24 H20 N4 O3 S2 |
| Smiles: | C(CNC(CSc1nc2ccc(cc2s1)/N=C/c1cccc(c1)[N+]([O-])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6872 |
| logD: | 4.6871 |
| logSw: | -4.7869 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.87 |
| InChI Key: | JPJDBUDSYSXRLY-UHFFFAOYSA-N |