3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl (2,4-dichlorophenoxy)acetate
Chemical Structure Depiction of
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl (2,4-dichlorophenoxy)acetate
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl (2,4-dichlorophenoxy)acetate
Compound characteristics
Compound ID: | C263-0399 |
Compound Name: | 3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl (2,4-dichlorophenoxy)acetate |
Molecular Weight: | 562.38 |
Molecular Formula: | C24 H17 Cl2 N3 O7 S |
Smiles: | Cc1c(c(n(c2ccccc2)n1)OC(COc1ccc(cc1[Cl])[Cl])=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6653 |
logD: | 4.6653 |
logSw: | -4.9453 |
Hydrogen bond acceptors count: | 13 |
Polar surface area: | 104.423 |
InChI Key: | NCNCENHNJUPMEK-UHFFFAOYSA-N |