1-methyl-6-{5-[(3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole
Chemical Structure Depiction of
1-methyl-6-{5-[(3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole
1-methyl-6-{5-[(3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole
Compound characteristics
| Compound ID: | P596-0148 |
| Compound Name: | 1-methyl-6-{5-[(3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazole |
| Molecular Weight: | 321.34 |
| Molecular Formula: | C17 H15 N5 O2 |
| Smiles: | Cc1cccc(c1)OCc1nc(c2ccc3c(c2)n(C)nn3)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.5712 |
| logD: | 3.5711 |
| logSw: | -3.6134 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.793 |
| InChI Key: | QLWSCPOOAVQCDT-UHFFFAOYSA-N |