1-[5-(anthracen-9-yl)-2-[(1H-benzotriazol-1-yl)methyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(anthracen-9-yl)-2-[(1H-benzotriazol-1-yl)methyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
1-[5-(anthracen-9-yl)-2-[(1H-benzotriazol-1-yl)methyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G642-7704 |
| Compound Name: | 1-[5-(anthracen-9-yl)-2-[(1H-benzotriazol-1-yl)methyl]-1,3,4-oxadiazol-3(2H)-yl]ethan-1-one |
| Molecular Weight: | 421.46 |
| Molecular Formula: | C25 H19 N5 O2 |
| Smiles: | CC(N1C(Cn2c3ccccc3nn2)OC(c2c3ccccc3cc3ccccc23)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5595 |
| logD: | 4.5595 |
| logSw: | -5.0062 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.6 |
| InChI Key: | ONVCOHMFZZCRQR-QHCPKHFHSA-N |