3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl cyclopropanecarboxylate
Chemical Structure Depiction of
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl cyclopropanecarboxylate
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl cyclopropanecarboxylate
Compound characteristics
Compound ID: | C263-0391 |
Compound Name: | 3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl cyclopropanecarboxylate |
Molecular Weight: | 427.43 |
Molecular Formula: | C20 H17 N3 O6 S |
Smiles: | Cc1c(c(n(c2ccccc2)n1)OC(C1CC1)=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2449 |
logD: | 3.2449 |
logSw: | -3.7908 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 97.956 |
InChI Key: | LBEZYVIBZYTEFR-UHFFFAOYSA-N |