1,5-dimethyl-4-nitro-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1,5-dimethyl-4-nitro-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide
1,5-dimethyl-4-nitro-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-1083 |
| Compound Name: | 1,5-dimethyl-4-nitro-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 352.35 |
| Molecular Formula: | C18 H16 N4 O4 |
| Smiles: | Cc1c(c(C(Nc2ccc(cc2)Oc2ccccc2)=O)nn1C)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3788 |
| logD: | 3.3761 |
| logSw: | -3.9177 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.89 |
| InChI Key: | LTDXVRURYZJJLL-UHFFFAOYSA-N |