6-{5-[(2-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-methyl-1H-benzotriazole
Chemical Structure Depiction of
6-{5-[(2-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-methyl-1H-benzotriazole
6-{5-[(2-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-methyl-1H-benzotriazole
Compound characteristics
| Compound ID: | P596-0132 |
| Compound Name: | 6-{5-[(2-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-methyl-1H-benzotriazole |
| Molecular Weight: | 355.78 |
| Molecular Formula: | C17 H14 Cl N5 O2 |
| Smiles: | Cn1c2cc(ccc2nn1)c1nc(Cc2ccc(cc2[Cl])OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.2251 |
| logD: | 4.2251 |
| logSw: | -4.6033 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.837 |
| InChI Key: | DDUQCVJGBMYGEP-UHFFFAOYSA-N |