3-methyl-4-(4-methylbenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-methoxybenzoate
Chemical Structure Depiction of
3-methyl-4-(4-methylbenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-methoxybenzoate
3-methyl-4-(4-methylbenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-methoxybenzoate
Compound characteristics
| Compound ID: | C263-0350 |
| Compound Name: | 3-methyl-4-(4-methylbenzene-1-sulfonyl)-1-phenyl-1H-pyrazol-5-yl 3-methoxybenzoate |
| Molecular Weight: | 462.52 |
| Molecular Formula: | C25 H22 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(c1c(C)nn(c2ccccc2)c1OC(c1cccc(c1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4503 |
| logD: | 4.4503 |
| logSw: | -4.5156 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.595 |
| InChI Key: | NZIBVFPYYAEINU-UHFFFAOYSA-N |