N-(3-nitrophenyl)-2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-nitrophenyl)-2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-(3-nitrophenyl)-2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8004-9107 |
| Compound Name: | N-(3-nitrophenyl)-2-[(6-{[(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 493.52 |
| Molecular Formula: | C22 H15 N5 O5 S2 |
| Smiles: | C(C(Nc1cccc(c1)[N+]([O-])=O)=O)Sc1nc2ccc(cc2s1)/N=C/c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2989 |
| logD: | 5.2982 |
| logSw: | -5.6379 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.088 |
| InChI Key: | HQSHUSWYIHLRFH-UHFFFAOYSA-N |