AC1LRBS7
ethyl 11-methyl-6-(4-methyl-3-nitrobenzoyl)imino-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: (Z)-ethyl 1-isobutyl-10-methyl-2-((4-methyl-3-nitrobenzoyl)imino)-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate|ethyl (2Z)-10-methyl-2-{[(4-methyl-3-nitrophenyl)carbonyl]imino}-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
| Molecular Formula | C27H27N5O6 |
|---|---|
| Molecular Weight | 517.1961 g/mol |
| LogP | 3.74804 |
| Topological Polar Surface Area | 138.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 517.1961 |
| Monoisotopic Mass | 517.1961 |
| Heavy Atoms | 38 |
| Complexity | 1749.4641 |
Chemical Identifiers
| CAS Number | 714922-80-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N=C3C(=CC=CN3C2=O)C)N(C1=NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])CC(C)C |
Product Overview
AC1LRBS7 (CAS 714922-80-2), with molecular formula C27H27N5O6 and molecular weight 517.1961 g/mol. IUPAC: ethyl 11-methyl-6-(4-methyl-3-nitrobenzoyl)imino-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
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