N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2H-1,3-benzodioxol-5-amine
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2H-1,3-benzodioxol-5-amine
N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2H-1,3-benzodioxol-5-amine
Compound characteristics
| Compound ID: | G221-0247 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2H-1,3-benzodioxol-5-amine |
| Molecular Weight: | 423.83 |
| Molecular Formula: | C22 H15 Cl F N3 O3 |
| Smiles: | C1Oc2ccc(cc2O1)NC(c1ccc(cc1[Cl])F)c1nnc(c2ccccc2)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4812 |
| logD: | 5.4812 |
| logSw: | -6.0919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.185 |
| InChI Key: | VZYBIDIZJWTOEM-HXUWFJFHSA-N |