1-(3-nitrobenzene-1-sulfonyl)-3-(3,4,5-triethoxyphenyl)-1H-pyrazol-5-amine
Chemical Structure Depiction of
1-(3-nitrobenzene-1-sulfonyl)-3-(3,4,5-triethoxyphenyl)-1H-pyrazol-5-amine
1-(3-nitrobenzene-1-sulfonyl)-3-(3,4,5-triethoxyphenyl)-1H-pyrazol-5-amine
Compound characteristics
| Compound ID: | C614-0268 |
| Compound Name: | 1-(3-nitrobenzene-1-sulfonyl)-3-(3,4,5-triethoxyphenyl)-1H-pyrazol-5-amine |
| Molecular Weight: | 476.51 |
| Molecular Formula: | C21 H24 N4 O7 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)c1cc(N)n(n1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2431 |
| logD: | 3.2431 |
| logSw: | -3.629 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.294 |
| InChI Key: | VRKKLNKOLNBCRP-UHFFFAOYSA-N |