N-[3,5-bis(trifluoromethyl)phenyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-[3,5-bis(trifluoromethyl)phenyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
N-[3,5-bis(trifluoromethyl)phenyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | Y501-7798 |
| Compound Name: | N-[3,5-bis(trifluoromethyl)phenyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide |
| Molecular Weight: | 458.32 |
| Molecular Formula: | C19 H12 F6 N4 O3 |
| Smiles: | C(c1cccc(c1)C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7367 |
| logD: | 3.1852 |
| logSw: | -4.7551 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.217 |
| InChI Key: | YHLDPULSJOQRSW-UHFFFAOYSA-N |