3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate
Chemical Structure Depiction of
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate
3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate
Compound characteristics
| Compound ID: | C263-0421 |
| Compound Name: | 3-methyl-4-(4-nitrobenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 2-chloro-6-fluorobenzoate |
| Molecular Weight: | 515.9 |
| Molecular Formula: | C23 H15 Cl F N3 O6 S |
| Smiles: | Cc1c(c(n(c2ccccc2)n1)OC(c1c(cccc1[Cl])F)=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4191 |
| logD: | 4.4191 |
| logSw: | -4.9055 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 97.433 |
| InChI Key: | UVKMGNIAAIDPQP-UHFFFAOYSA-N |