methyl 4-{[3,5-dimethyl-1-(4-methylphenyl)-1H-pyrazole-4-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[3,5-dimethyl-1-(4-methylphenyl)-1H-pyrazole-4-sulfonyl]amino}benzoate
methyl 4-{[3,5-dimethyl-1-(4-methylphenyl)-1H-pyrazole-4-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | F828-2169 |
| Compound Name: | methyl 4-{[3,5-dimethyl-1-(4-methylphenyl)-1H-pyrazole-4-sulfonyl]amino}benzoate |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | Cc1ccc(cc1)n1c(C)c(c(C)n1)S(Nc1ccc(cc1)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5927 |
| logD: | 3.0504 |
| logSw: | -3.7695 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.48 |
| InChI Key: | PNNKDVWFEPSNRS-UHFFFAOYSA-N |