N-[(2-ethoxyphenyl)methyl]-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(2-ethoxyphenyl)methyl]-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
N-[(2-ethoxyphenyl)methyl]-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
Compound ID: | Y500-2323 |
Compound Name: | N-[(2-ethoxyphenyl)methyl]-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide |
Molecular Weight: | 318.33 |
Molecular Formula: | C15 H18 N4 O4 |
Smiles: | CCn1cc(c(C(NCc2ccccc2OCC)=O)n1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 1.9845 |
logD: | 1.9836 |
logSw: | -2.2025 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.991 |
InChI Key: | VRZYJKMVDAVVLL-UHFFFAOYSA-N |