1-[3-chloro-4-(trifluoromethyl)phenyl]-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-5-amine
Chemical Structure Depiction of
1-[3-chloro-4-(trifluoromethyl)phenyl]-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-5-amine
1-[3-chloro-4-(trifluoromethyl)phenyl]-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-5-amine
Compound characteristics
Compound ID: | E595-0428 |
Compound Name: | 1-[3-chloro-4-(trifluoromethyl)phenyl]-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-5-amine |
Molecular Weight: | 436.78 |
Molecular Formula: | C18 H12 Cl F3 N6 O2 |
Smiles: | COc1ccc(cc1)c1nc(c2c(N)n(c3ccc(c(c3)[Cl])C(F)(F)F)nn2)on1 |
Stereo: | ACHIRAL |
logP: | 4.4297 |
logD: | 4.4297 |
logSw: | -4.8135 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.282 |
InChI Key: | VPNFNUKVNJKRAC-UHFFFAOYSA-N |