2-({6-[({4-[(1,3-benzothiazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenoxyethyl)acetamide
Chemical Structure Depiction of
2-({6-[({4-[(1,3-benzothiazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenoxyethyl)acetamide
2-({6-[({4-[(1,3-benzothiazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenoxyethyl)acetamide
Compound characteristics
| Compound ID: | 8009-3090 |
| Compound Name: | 2-({6-[({4-[(1,3-benzothiazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-N-(2-phenoxyethyl)acetamide |
| Molecular Weight: | 657.81 |
| Molecular Formula: | C31 H23 N5 O4 S4 |
| Smiles: | C(COc1ccccc1)NC(CSc1nc2ccc(cc2s1)/N=C/c1ccc(c(c1)[N+]([O-])=O)Sc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 8.3237 |
| logD: | 8.3237 |
| logSw: | -6.1081 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.797 |
| InChI Key: | SHUODLNWRTZWKO-UHFFFAOYSA-N |