N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)benzamide
Chemical Structure Depiction of
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)benzamide
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)benzamide
Compound characteristics
| Compound ID: | Y042-4070 |
| Compound Name: | N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)benzamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C20 H18 N6 O2 S |
| Smiles: | CC(C)(C)c1nnc(NC(c2ccc(cc2)N2C(c3ccccc3N=N2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.4764 |
| logD: | 3.6034 |
| logSw: | -4.3246 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.15 |
| InChI Key: | CUFKPJGBFYMGKY-UHFFFAOYSA-N |