AC1OBXTW
2-amino-1-[(E)-pyridin-3-ylmethylideneamino]-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: (E)-2-amino-1-((pyridin-3-ylmethylene)amino)-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide|F3225-5283|2-amino-1-[(E)-[(pyridin-3-yl)methylidene]amino]-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide|2-amino-1-[(E)-pyridin-3-ylmethylideneamino]-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide|2-amino-1-{[(E)-pyridin-3-ylmethylidene]amino}-N-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
| Molecular Formula | C22H17N7OS |
|---|---|
| Molecular Weight | 427.12152 g/mol |
| LogP | 3.4354 |
| Topological Polar Surface Area | 111.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.12152 |
| Monoisotopic Mass | 427.12152 |
| Heavy Atoms | 31 |
| Complexity | 1408.6466 |
Chemical Identifiers
| CAS Number | 841206-75-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3C(=C(N(C3=N2)/N=C/C4=CN=CC=C4)N)C(=O)NCC5=CC=CS5 |
Product Overview
AC1OBXTW (CAS 841206-75-5), with molecular formula C22H17N7OS and molecular weight 427.12152 g/mol. IUPAC: 2-amino-1-[(E)-pyridin-3-ylmethylideneamino]-N-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide.
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