N-[2-(difluoromethoxy)phenyl]-5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-amine
Chemical Structure Depiction of
N-[2-(difluoromethoxy)phenyl]-5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-amine
N-[2-(difluoromethoxy)phenyl]-5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-amine
Compound characteristics
Compound ID: | C301-0211 |
Compound Name: | N-[2-(difluoromethoxy)phenyl]-5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-amine |
Molecular Weight: | 363.28 |
Molecular Formula: | C15 H11 F2 N5 O4 |
Smiles: | c1ccc(cc1)n1nc(c(Nc2ccccc2OC(F)F)[n+]1[O-])[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.176 |
logD: | 3.176 |
logSw: | -3.4773 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.077 |
InChI Key: | OSMTUMJBYCMVAM-UHFFFAOYSA-N |