1-({[1-(4-fluorophenyl)ethylidene]amino}oxy)-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propan-1-one
Chemical Structure Depiction of
1-({[1-(4-fluorophenyl)ethylidene]amino}oxy)-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propan-1-one
1-({[1-(4-fluorophenyl)ethylidene]amino}oxy)-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propan-1-one
Compound characteristics
| Compound ID: | C071-0231 |
| Compound Name: | 1-({[1-(4-fluorophenyl)ethylidene]amino}oxy)-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]propan-1-one |
| Molecular Weight: | 501.48 |
| Molecular Formula: | C20 H15 F4 N3 O4 S2 |
| Smiles: | C\C(c1ccc(cc1)F)=N/OC(CCS(c1nc(cc(C(F)(F)F)n1)c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1918 |
| logD: | 4.1918 |
| logSw: | -4.3183 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.857 |
| InChI Key: | KIHXRPVTTGCDPY-UHFFFAOYSA-N |