methyl 2-{[4-(2,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(2,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carbonyl]amino}benzoate
methyl 2-{[4-(2,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | Y510-4860 |
| Compound Name: | methyl 2-{[4-(2,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carbonyl]amino}benzoate |
| Molecular Weight: | 434.28 |
| Molecular Formula: | C20 H17 Cl2 N3 O4 |
| Smiles: | CC1=C(C(c2ccc(cc2[Cl])[Cl])NC(N1)=O)C(Nc1ccccc1C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6636 |
| logD: | 3.4473 |
| logSw: | -4.0596 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.259 |
| InChI Key: | WQQWLJIYQWDQMB-KRWDZBQOSA-N |