3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3,4,5-trimethoxybenzoate
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | C263-0431 |
| Compound Name: | 3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 553.55 |
| Molecular Formula: | C26 H23 N3 O9 S |
| Smiles: | Cc1c(c(n(c2ccccc2)n1)OC(c1cc(c(c(c1)OC)OC)OC)=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.442 |
| logD: | 3.442 |
| logSw: | -4.0546 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 120.41 |
| InChI Key: | UGUVYEGFGCMWEU-UHFFFAOYSA-N |