AC1MJFQK
3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: Oprea1_211375|Oprea1_715996|BAS 00553039|AG-690/37024070|SR-01000367469-1|3-methylbutyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate|isopentyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate|3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,3,6-t rihydropyrimidine-5-carboxylate|isopentyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C19H25BrN2O5 |
|---|---|
| Molecular Weight | 440.09467 g/mol |
| LogP | 3.7227 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.09467 |
| Monoisotopic Mass | 440.09467 |
| Heavy Atoms | 27 |
| Complexity | 775.60864 |
Chemical Identifiers
| CAS Number | 418808-86-3 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC(=C(C(=C2)Br)O)OC)C(=O)OCCC(C)C |
Product Overview
AC1MJFQK (CAS 418808-86-3), with molecular formula C19H25BrN2O5 and molecular weight 440.09467 g/mol. IUPAC: 3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
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