2,2,2-trifluoroethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2,2,2-trifluoroethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2,2,2-trifluoroethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 5991-0073 |
| Compound Name: | 2,2,2-trifluoroethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 450.41 |
| Molecular Formula: | C22 H21 F3 N2 O5 |
| Smiles: | CC1=C(C(c2ccc(c(c2)OC)OCc2ccccc2)NC(N1)=O)C(=O)OCC(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2535 |
| logD: | 3.1032 |
| logSw: | -3.4403 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.765 |
| InChI Key: | QSVTXGMGDFRDHH-IBGZPJMESA-N |