ethyl 4-(4-tert-butylphenyl)-1-methyl-2-oxo-6-{[3-(trifluoromethyl)phenoxy]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-tert-butylphenyl)-1-methyl-2-oxo-6-{[3-(trifluoromethyl)phenoxy]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(4-tert-butylphenyl)-1-methyl-2-oxo-6-{[3-(trifluoromethyl)phenoxy]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V003-4211 |
| Compound Name: | ethyl 4-(4-tert-butylphenyl)-1-methyl-2-oxo-6-{[3-(trifluoromethyl)phenoxy]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 490.52 |
| Molecular Formula: | C26 H29 F3 N2 O4 |
| Smiles: | CCOC(C1C(c2ccc(cc2)C(C)(C)C)NC(N(C)C=1COc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9536 |
| logD: | 5.9482 |
| logSw: | -5.6274 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.018 |
| InChI Key: | OKGGWADFHMCOPK-JOCHJYFZSA-N |