2-[(propan-2-yl)oxy]ethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-[(propan-2-yl)oxy]ethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-[(propan-2-yl)oxy]ethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 3999-6390 |
| Compound Name: | 2-[(propan-2-yl)oxy]ethyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 441.28 |
| Molecular Formula: | C18 H21 Br N2 O6 |
| Smiles: | CC(C)OCCOC(C1C(c2cc3c(cc2[Br])OCO3)NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9451 |
| logD: | 1.8366 |
| logSw: | -2.654 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.056 |
| InChI Key: | DJJJYBSLHSBJDE-INIZCTEOSA-N |