AC1LUARR
ethyl 11-methyl-6-(3-nitrobenzoyl)imino-2-oxo-7-(3-propan-2-yloxypropyl)-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-(3-isopropoxypropyl)-10-methyl-2-((3-nitrobenzoyl)imino)-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate|ethyl (2Z)-10-methyl-2-{[(3-nitrophenyl)carbonyl]imino}-5-oxo-1-[3-(propan-2-yloxy)propyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
| Molecular Formula | C28H29N5O7 |
|---|---|
| Molecular Weight | 547.2067 g/mol |
| LogP | 3.59872 |
| Topological Polar Surface Area | 147.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 547.2067 |
| Monoisotopic Mass | 547.2067 |
| Heavy Atoms | 40 |
| Complexity | 1754.3092 |
Chemical Identifiers
| CAS Number | 714253-98-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N=C3C(=CC=CN3C2=O)C)N(C1=NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])CCCOC(C)C |
Product Overview
AC1LUARR (CAS 714253-98-2), with molecular formula C28H29N5O7 and molecular weight 547.2067 g/mol. IUPAC: ethyl 11-methyl-6-(3-nitrobenzoyl)imino-2-oxo-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
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