ethyl 4-[(3,7-dimethylocta-2,6-dien-1-yl)amino]-2-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[(3,7-dimethylocta-2,6-dien-1-yl)amino]-2-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxylate
ethyl 4-[(3,7-dimethylocta-2,6-dien-1-yl)amino]-2-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V027-7130 |
| Compound Name: | ethyl 4-[(3,7-dimethylocta-2,6-dien-1-yl)amino]-2-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxylate |
| Molecular Weight: | 447.5 |
| Molecular Formula: | C24 H28 F3 N3 O2 |
| Salt: | not_available |
| Smiles: | CCOC(c1cnc(c2cccc(c2)C(F)(F)F)nc1NC\C=C(/C)CCC=C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7174 |
| logD: | 7.7174 |
| logSw: | -5.6626 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.801 |
| InChI Key: | NHOPRZGPTSAZHU-UHFFFAOYSA-N |