1-{2-[(1H-benzotriazol-1-yl)methyl]-5-[3-(benzyloxy)-4-methoxyphenyl]-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{2-[(1H-benzotriazol-1-yl)methyl]-5-[3-(benzyloxy)-4-methoxyphenyl]-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
1-{2-[(1H-benzotriazol-1-yl)methyl]-5-[3-(benzyloxy)-4-methoxyphenyl]-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | G642-7708 |
| Compound Name: | 1-{2-[(1H-benzotriazol-1-yl)methyl]-5-[3-(benzyloxy)-4-methoxyphenyl]-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C25 H23 N5 O4 |
| Smiles: | CC(N1C(Cn2c3ccccc3nn2)OC(c2ccc(c(c2)OCc2ccccc2)OC)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3187 |
| logD: | 3.3187 |
| logSw: | -3.5264 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.088 |
| InChI Key: | RWHLDILYCRZODN-DEOSSOPVSA-N |