methyl 1-butyl-6-methyl-2-oxo-4-(3-{[3-(trifluoromethyl)phenyl]carbamamido}phenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 1-butyl-6-methyl-2-oxo-4-(3-{[3-(trifluoromethyl)phenyl]carbamamido}phenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 1-butyl-6-methyl-2-oxo-4-(3-{[3-(trifluoromethyl)phenyl]carbamamido}phenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V014-3531 |
| Compound Name: | methyl 1-butyl-6-methyl-2-oxo-4-(3-{[3-(trifluoromethyl)phenyl]carbamamido}phenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 504.51 |
| Molecular Formula: | C25 H27 F3 N4 O4 |
| Smiles: | CCCCN1C(C)=C(C(c2cccc(c2)NC(Nc2cccc(c2)C(F)(F)F)=O)NC1=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8402 |
| logD: | 5.8386 |
| logSw: | -5.494 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.365 |
| InChI Key: | JIGVFGDIMYSAKZ-NRFANRHFSA-N |