N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitro-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitro-N-(propan-2-yl)benzamide
N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitro-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V026-9636F |
| Compound Name: | N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitro-N-(propan-2-yl)benzamide |
| Molecular Weight: | 501.52 |
| Molecular Formula: | C27 H24 F N5 O4 |
| Smiles: | CC(C)N(CC(Nc1cc(c2ccccc2)nn1c1ccc(cc1)F)=O)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3489 |
| logD: | 5.3489 |
| logSw: | -5.3446 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.887 |
| InChI Key: | IJJMXFKFHZLFOK-UHFFFAOYSA-N |