N-[(4-fluorophenyl)methyl]-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
N-[(4-fluorophenyl)methyl]-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | V011-9794 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-(1-methyl-1H-pyrrol-2-yl)-1-(3-nitrophenyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 419.41 |
| Molecular Formula: | C22 H18 F N5 O3 |
| Smiles: | Cn1cccc1c1cc(C(NCc2ccc(cc2)F)=O)n(c2cccc(c2)[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.483 |
| logD: | 4.483 |
| logSw: | -4.3546 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.273 |
| InChI Key: | VONUFWHPMRMLAO-UHFFFAOYSA-N |