4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}butanamide
Chemical Structure Depiction of
4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}butanamide
4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}butanamide
Compound characteristics
| Compound ID: | C071-0454 |
| Compound Name: | 4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}butanamide |
| Molecular Weight: | 573.59 |
| Molecular Formula: | C27 H26 F3 N5 O4 S |
| Smiles: | Cc1ccc(Cn2ccc(NC(CCCS(c3nc(cc(C(F)(F)F)n3)c3ccccc3OC)(=O)=O)=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9048 |
| logD: | 3.8965 |
| logSw: | -3.9935 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.588 |
| InChI Key: | PHESOAFTVFJBIQ-UHFFFAOYSA-N |