N-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propanamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propanamide
N-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propanamide
Compound characteristics
| Compound ID: | C071-0226 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propanamide |
| Molecular Weight: | 584.04 |
| Molecular Formula: | C24 H21 Cl F3 N5 O3 S2 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)[Cl])n1)NC(CCS(c1nc(cc(C(F)(F)F)n1)c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9673 |
| logD: | 3.9672 |
| logSw: | -4.4449 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.906 |
| InChI Key: | LMEZEJXYQTVCKV-UHFFFAOYSA-N |