methyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8008-3434 |
| Compound Name: | methyl 4-(6-bromo-2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 383.2 |
| Molecular Formula: | C15 H15 Br N2 O5 |
| Smiles: | CC1=C(C(c2cc3c(cc2[Br])OCO3)NC(N1C)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0351 |
| logD: | 2.035 |
| logSw: | -2.5774 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.964 |
| InChI Key: | RBOASGYPJBSZNJ-ZDUSSCGKSA-N |