heptyl 6-methyl-2-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
heptyl 6-methyl-2-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
heptyl 6-methyl-2-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8012-2739 |
| Compound Name: | heptyl 6-methyl-2-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 414.42 |
| Molecular Formula: | C20 H25 F3 N2 O4 |
| Smiles: | CCCCCCCOC(C1C(c2ccc(cc2)OC(F)(F)F)NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2631 |
| logD: | 5.1129 |
| logSw: | -5.0418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.676 |
| InChI Key: | ONTXGHHHVQJMQH-KRWDZBQOSA-N |