methyl 4-(2,5-dimethylphenyl)-6-({[(4-fluorophenyl)methyl]amino}methyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-(2,5-dimethylphenyl)-6-({[(4-fluorophenyl)methyl]amino}methyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-(2,5-dimethylphenyl)-6-({[(4-fluorophenyl)methyl]amino}methyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8020-4614 |
| Compound Name: | methyl 4-(2,5-dimethylphenyl)-6-({[(4-fluorophenyl)methyl]amino}methyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C22 H24 F N3 O3 |
| Smiles: | Cc1ccc(C)c(c1)C1C(=C(CNCc2ccc(cc2)F)NC(N1)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0755 |
| logD: | 3.0755 |
| logSw: | -3.0608 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.238 |
| InChI Key: | QTPKZFAINQPMSG-HXUWFJFHSA-N |