2-(ethylsulfanyl)ethyl 4-(3-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 4-(3-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-(ethylsulfanyl)ethyl 4-(3-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 2251-3096 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 4-(3-bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 399.3 |
| Molecular Formula: | C16 H19 Br N2 O3 S |
| Smiles: | CCSCCOC(C1C(c2cccc(c2)[Br])NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0125 |
| logD: | 2.8622 |
| logSw: | -3.2326 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.739 |
| InChI Key: | BACWJVRCQGCPQH-AWEZNQCLSA-N |