N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[(7-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[(7-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl)sulfanyl]acetamide
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[(7-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G199-0056 |
| Compound Name: | N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[(7-oxo-2-phenyl-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C16 H13 N7 O2 S2 |
| Smiles: | Cc1nnc(NC(CSC2=NC(c3ccccc3)=NC3=CC(NN23)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.4453 |
| logD: | 1.4148 |
| logSw: | -2.1804 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.434 |
| InChI Key: | KPELGYSUXDGWKX-UHFFFAOYSA-N |