4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methyl-1H-pyrazol-5-yl 3-fluorobenzoate
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methyl-1H-pyrazol-5-yl 3-fluorobenzoate
4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methyl-1H-pyrazol-5-yl 3-fluorobenzoate
Compound characteristics
| Compound ID: | C263-0459 |
| Compound Name: | 4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methyl-1H-pyrazol-5-yl 3-fluorobenzoate |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C25 H21 F N2 O4 S |
| Smiles: | Cc1ccc(c(C)c1)n1c(c(c(C)n1)S(c1ccccc1)(=O)=O)OC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1239 |
| logD: | 5.1239 |
| logSw: | -5.0939 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.75 |
| InChI Key: | MMIMMCJWEFRHSF-UHFFFAOYSA-N |