N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | C163-0308 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C19 H26 N4 O5 |
| Smiles: | Cc1c(c(C)n(CCCC(NCCc2ccc(c(c2)OC)OC)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.4225 |
| logD: | 0.4225 |
| logSw: | -2.1228 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.852 |
| InChI Key: | JIMILSKFUAWYCM-UHFFFAOYSA-N |