4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-1-({[1-(pyridin-4-yl)ethylidene]amino}oxy)butan-1-one
Chemical Structure Depiction of
4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-1-({[1-(pyridin-4-yl)ethylidene]amino}oxy)butan-1-one
4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-1-({[1-(pyridin-4-yl)ethylidene]amino}oxy)butan-1-one
Compound characteristics
| Compound ID: | C071-0583 |
| Compound Name: | 4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-1-({[1-(pyridin-4-yl)ethylidene]amino}oxy)butan-1-one |
| Molecular Weight: | 552.53 |
| Molecular Formula: | C24 H23 F3 N4 O6 S |
| Smiles: | C\C(c1ccncc1)=N/OC(CCCS(c1nc(cc(C(F)(F)F)n1)c1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9503 |
| logD: | 2.9483 |
| logSw: | -3.2433 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 102.527 |
| InChI Key: | ZUIMEEFNDKLYCB-UHFFFAOYSA-N |