N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-chloro-4-fluorophenyl)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)methanamine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-chloro-4-fluorophenyl)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)methanamine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-chloro-4-fluorophenyl)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)methanamine
Compound characteristics
| Compound ID: | C301-6107 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-chloro-4-fluorophenyl)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)methanamine |
| Molecular Weight: | 437.86 |
| Molecular Formula: | C23 H17 Cl F N3 O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc(cc1[Cl])F)c1nnc(c2ccccc2)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7592 |
| logD: | 4.758 |
| logSw: | -5.0485 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.507 |
| InChI Key: | FHWTVROAHHGVSB-OAQYLSRUSA-N |