N-[2-(1H-benzimidazol-2-yl)ethyl]-1-[(4-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-1-[(4-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-1-[(4-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-8083 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-1-[(4-fluorophenyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 408.39 |
| Molecular Formula: | C20 H17 F N6 O3 |
| Smiles: | C(CNC(c1cc(nn1Cc1ccc(cc1)F)[N+]([O-])=O)=O)c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.5083 |
| logD: | 2.5078 |
| logSw: | -2.914 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.578 |
| InChI Key: | YJEUPQDMGWRQGS-UHFFFAOYSA-N |