AC1NSK3B
N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-yl]amino]pentan-2-yl]-5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxamide
Also Known As: GUANOSINE TRIPHOSPHATE|N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-yl]amino]pentan-2-yl]-5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxamide
CAS: 86-01-1
| Molecular Formula | C40H47N5O7 |
|---|---|
| Molecular Weight | 709.34753 g/mol |
| LogP | 4.2693 |
| Topological Polar Surface Area | 143.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 709.34753 |
| Monoisotopic Mass | 709.34753 |
| Heavy Atoms | 52 |
| Complexity | 1853.3494 |
Chemical Identifiers
| CAS Number | 86-01-1 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)NC1CCCN(CC1=O)C(=O)CC2=CC(=CC=C2)C3=CC=CC=N3)NC(=O)C4=CC5=C(O4)C=CC(=C5)OCCN6CCOCC6 |
Product Overview
AC1NSK3B (CAS 86-01-1), with molecular formula C40H47N5O7 and molecular weight 709.34753 g/mol. IUPAC: N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-yl]amino]pentan-2-yl]-5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxamide.
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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