ethyl 4-(3-fluorophenyl)-2-oxo-6-({N-[(pyridin-3-yl)methyl]-4-(trifluoroacetyl)benzamido}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-fluorophenyl)-2-oxo-6-({N-[(pyridin-3-yl)methyl]-4-(trifluoroacetyl)benzamido}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3-fluorophenyl)-2-oxo-6-({N-[(pyridin-3-yl)methyl]-4-(trifluoroacetyl)benzamido}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8018-2454 |
| Compound Name: | ethyl 4-(3-fluorophenyl)-2-oxo-6-({N-[(pyridin-3-yl)methyl]-4-(trifluoroacetyl)benzamido}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 584.53 |
| Molecular Formula: | C29 H24 F4 N4 O5 |
| Smiles: | CCOC(C1C(c2cccc(c2)F)NC(NC=1CN(Cc1cccnc1)C(c1ccc(cc1)C(C(F)(F)F)=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9349 |
| logD: | 2.7193 |
| logSw: | -3.1027 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.248 |
| InChI Key: | UJVIAQOVCUPSDI-DEOSSOPVSA-N |