N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-1H-pyrazole-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | 8010-6997 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 320.3 |
| Molecular Formula: | C14 H16 N4 O5 |
| Smiles: | COc1ccc(CCNC(c2c(c[nH]n2)[N+]([O-])=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 0.7288 |
| logD: | 0.6753 |
| logSw: | -2.2169 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.296 |
| InChI Key: | ZZYXOZDOAUYJMM-UHFFFAOYSA-N |