AC1MEZLV
butyl 3,4-dimethyl-6-(4-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: BAS 00648573|butyl 1,6-dimethyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|SR-01000408544-1|butyl 3,4-dimethyl-6-(4-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate|butyl 1,6-dimethyl-4-(4-nitrophenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate|butyl 3,4-dimethyl-6-(4-nitrophenyl)-2-oxo-1,3,6-trihydropyrimidine-5-carboxyl ate
| Molecular Formula | C17H21N3O5 |
|---|---|
| Molecular Weight | 347.14813 g/mol |
| LogP | 2.9082 |
| Topological Polar Surface Area | 101.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.14813 |
| Monoisotopic Mass | 347.14813 |
| Heavy Atoms | 25 |
| Complexity | 711.4984 |
Chemical Identifiers
| CAS Number | 5709-40-0 |
|---|---|
| SMILES | CCCCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)[N+](=O)[O-])C)C |
Product Overview
AC1MEZLV (CAS 5709-40-0), with molecular formula C17H21N3O5 and molecular weight 347.14813 g/mol. IUPAC: butyl 3,4-dimethyl-6-(4-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
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