1-methyl-6-{5-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole
Chemical Structure Depiction of
1-methyl-6-{5-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole
1-methyl-6-{5-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole
Compound characteristics
| Compound ID: | P596-0049 |
| Compound Name: | 1-methyl-6-{5-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole |
| Molecular Weight: | 305.34 |
| Molecular Formula: | C17 H15 N5 O |
| Smiles: | Cc1ccc(Cc2nc(c3ccc4c(c3)n(C)nn4)no2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7176 |
| logD: | 3.7176 |
| logSw: | -3.9377 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.293 |
| InChI Key: | ALVUMAYBNMCZJR-UHFFFAOYSA-N |