AC1OBO1O
3-[(E)-(4-nitrophenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-{[(E)-(4-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one|(E)-3-((4-nitrobenzylidene)amino)-3H-pyrimido[5,4-b]indol-4(5H)-one|3-[(E)-(4-nitrophenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one
CAS: 299409-07-7
| Molecular Formula | C17H11N5O3 |
|---|---|
| Molecular Weight | 333.08618 g/mol |
| LogP | 2.6682 |
| Topological Polar Surface Area | 106.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.08618 |
| Monoisotopic Mass | 333.08618 |
| Heavy Atoms | 25 |
| Complexity | 1188.5852 |
Chemical Identifiers
| CAS Number | 299409-07-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C=N3)/N=C/C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
AC1OBO1O (CAS 299409-07-7), with molecular formula C17H11N5O3 and molecular weight 333.08618 g/mol. IUPAC: 3-[(E)-(4-nitrophenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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