2-[(3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-[(3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide
2-[(3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | G786-1997 |
| Compound Name: | 2-[(3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C18 H21 N5 O2 S2 |
| Smiles: | Cc1ccc(C)c(c1)NC(CSC1=NN2C(=NN=C(C2=O)C(C)(C)C)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9601 |
| logD: | 3.9595 |
| logSw: | -3.8004 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.967 |
| InChI Key: | KXDZYQFDDZYYPQ-UHFFFAOYSA-N |