N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-3-nitrobenzene-1-sulfonamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y504-5764 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C22 H26 N4 O6 S |
| Smiles: | CCn1c(CN(CCc2ccc(c(c2)OC)OC)S(c2cccc(c2)[N+]([O-])=O)(=O)=O)ccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.772 |
| logD: | 2.772 |
| logSw: | -3.2905 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 93.533 |
| InChI Key: | HACXSQXVDATHBY-UHFFFAOYSA-N |