prop-2-en-1-yl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
prop-2-en-1-yl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 2204-2975 |
| Compound Name: | prop-2-en-1-yl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 423.26 |
| Molecular Formula: | C18 H19 Br N2 O5 |
| Smiles: | CCN1C(C)=C(C(c2cc3c(cc2[Br])OCO3)NC1=O)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0565 |
| logD: | 3.0565 |
| logSw: | -3.1736 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.797 |
| InChI Key: | HQNQUETUMBNXSS-INIZCTEOSA-N |