AC1OBNYP
methyl 4-[(E)-[2-amino-3-(2-phenylethylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]iminomethyl]benzoate
Also Known As: (E)-methyl 4-(((2-amino-3-(phenethylcarbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)imino)methyl)benzoate|methyl 4-[(E)-({2-amino-3-[(2-phenylethyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}imino)methyl]benzoate|methyl 4-[(E)-[2-amino-3-(phenethylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]iminomethyl]benzoate
CAS: 836645-24-0
| Molecular Formula | C28H24N6O3 |
|---|---|
| Molecular Weight | 492.19098 g/mol |
| LogP | 3.808 |
| Topological Polar Surface Area | 124.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.19098 |
| Monoisotopic Mass | 492.19098 |
| Heavy Atoms | 37 |
| Complexity | 1625.4594 |
Chemical Identifiers
| CAS Number | 836645-24-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=N/N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N |
Product Overview
AC1OBNYP (CAS 836645-24-0), with molecular formula C28H24N6O3 and molecular weight 492.19098 g/mol. IUPAC: methyl 4-[(E)-[2-amino-3-(2-phenylethylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]iminomethyl]benzoate.
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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