N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C663-0078 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C17 H17 N7 O2 S3 |
| Smiles: | CCc1nnc(NC(CSc2nnc(CN3C(=O)Sc4ccccc34)n2C)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.243 |
| logD: | 2.1953 |
| logSw: | -2.6927 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.061 |
| InChI Key: | WCNNLFRTSVDXKE-UHFFFAOYSA-N |