N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8007-2392 |
| Compound Name: | N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C17 H12 N4 O3 S4 |
| Smiles: | CSc1nc2ccc(cc2s1)NC(CSc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3517 |
| logD: | 5.3517 |
| logSw: | -5.2891 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.661 |
| InChI Key: | JRHBCXCMCJKVFA-UHFFFAOYSA-N |