2-({5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-({5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
2-({5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 7641-0018 |
| Compound Name: | 2-({5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C18 H15 N5 O4 S3 |
| Smiles: | COc1ccc(cc1)NC(CSc1nnc(NC2c3ccccc3S(N=2)(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0567 |
| logD: | 2.1402 |
| logSw: | -3.7954 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.172 |
| InChI Key: | VNSSJHSAXGTKCM-UHFFFAOYSA-N |