1-methyl-N-(3-nitro-5-phenoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-(3-nitro-5-phenoxyphenyl)-1H-pyrazole-3-carboxamide
1-methyl-N-(3-nitro-5-phenoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y508-0936 |
| Compound Name: | 1-methyl-N-(3-nitro-5-phenoxyphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 338.32 |
| Molecular Formula: | C17 H14 N4 O4 |
| Smiles: | Cn1ccc(C(Nc2cc(cc(c2)Oc2ccccc2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1878 |
| logD: | 3.184 |
| logSw: | -3.7089 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.151 |
| InChI Key: | NICVSNAINDHUGU-UHFFFAOYSA-N |