N-benzyl-N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitrobenzamide
Chemical Structure Depiction of
N-benzyl-N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitrobenzamide
N-benzyl-N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | V015-9313 |
| Compound Name: | N-benzyl-N-(2-{[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)-3-nitrobenzamide |
| Molecular Weight: | 549.56 |
| Molecular Formula: | C31 H24 F N5 O4 |
| Smiles: | C(C(Nc1cc(c2ccccc2)nn1c1ccc(cc1)F)=O)N(Cc1ccccc1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7433 |
| logD: | 5.7433 |
| logSw: | -5.8712 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.872 |
| InChI Key: | PLWNPELQYITZGC-UHFFFAOYSA-N |