3-(3,4-dimethoxyphenyl)-1-(3-nitrobenzene-1-sulfonyl)-1H-pyrazol-5-amine
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-1-(3-nitrobenzene-1-sulfonyl)-1H-pyrazol-5-amine
3-(3,4-dimethoxyphenyl)-1-(3-nitrobenzene-1-sulfonyl)-1H-pyrazol-5-amine
Compound characteristics
| Compound ID: | C665-0057 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-1-(3-nitrobenzene-1-sulfonyl)-1H-pyrazol-5-amine |
| Molecular Weight: | 404.4 |
| Molecular Formula: | C17 H16 N4 O6 S |
| Smiles: | COc1ccc(cc1OC)c1cc(N)n(n1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3258 |
| logD: | 2.3258 |
| logSw: | -2.7417 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.838 |
| InChI Key: | BYHWIYOLXJWXEE-UHFFFAOYSA-N |