ethyl 3-acetyl-4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 3-acetyl-4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 3-acetyl-4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 4476-0124 |
Compound Name: | ethyl 3-acetyl-4-(4-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 381.22 |
Molecular Formula: | C16 H17 Br N2 O4 |
Smiles: | [H]N1C(C)=C(C(c2ccc(cc2)[Br])N(C(C)=O)C1=O)C(=O)OCC |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8471 |
logD: | -0.147 |
logSw: | -3.0512 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.735 |
InChI Key: | NJZGOXQVZHMHFC-AWEZNQCLSA-N |