2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | C663-0077 |
| Compound Name: | 2-({4-methyl-5-[(2-oxo-1,3-benzothiazol-3(2H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C16 H15 N7 O2 S3 |
| Smiles: | Cc1nnc(NC(CSc2nnc(CN3C(=O)Sc4ccccc34)n2C)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.4789 |
| logD: | 1.429 |
| logSw: | -2.3477 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.372 |
| InChI Key: | LIUAWCWSQQZGIF-UHFFFAOYSA-N |