N-[2-(4-chlorophenyl)ethyl]-1-[(2-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-1-[(2-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide
N-[2-(4-chlorophenyl)ethyl]-1-[(2-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
Compound ID: | 8018-2138 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-1-[(2-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide |
Molecular Weight: | 402.81 |
Molecular Formula: | C19 H16 Cl F N4 O3 |
Smiles: | C(CNC(c1cc(nn1Cc1ccccc1F)[N+]([O-])=O)=O)c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.509 |
logD: | 3.509 |
logSw: | -4.0836 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.297 |
InChI Key: | CYLDYPWFNIPYOW-UHFFFAOYSA-N |