N-[(4-methoxyphenyl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
N-[(4-methoxyphenyl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | 8013-5893 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 290.28 |
| Molecular Formula: | C13 H14 N4 O4 |
| Smiles: | Cn1cc(c(C(NCc2ccc(cc2)OC)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9503 |
| logD: | 0.9502 |
| logSw: | -1.9098 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.632 |
| InChI Key: | BHWGLTDEVLNDOF-UHFFFAOYSA-N |