DS-003 structure

DS-003

2-[1-[2-(4-methoxy-7-pyrazin-2-yl-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetyl]piperidin-4-ylidene]-2-phenylacetonitrile

Also Known As: DS-003|DS003|2-[1-[2-(4-methoxy-7-pyrazin-2-yl-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxo-acetyl]-4-piperidylidene]-2-phenyl-acetonitrile|2-(1-(2-(4-Methoxy-7-(pyrazin-2-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetyl)piperidin-4-ylidene)-2-phenylacetonitrile|2-[1-[2-(4-methoxy-7-pyrazin-2-yl-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetyl]piperidin-4-ylidene]-2-phenylacetonitrile|alpha-[1-[2-[4-Methoxy-7-(2-pyrazinyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-oxoacetyl]-4-piperidinylidene]benzeneacetonitrile|Benzeneacetonitrile, alpha-[1-[2-[4-methoxy-7-(2-pyrazinyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-oxoacetyl]-4-piperidinylidene]-|Piperidine, 4-(cyanophenylmethylene)-1-[(4-methoxy-7-pyrazinyl-1H-pyrrolo[2,3-c]pyridin-3-yl)oxoacetyl]-|Piperidine, 4-(cyanophenylmethylene)-1-[2-(4-methoxy-7-pyrazinyl-1H-pyrrolo[2,3-c]pyridin-3-yl)-1,2-dioxoethyl]-

CAS: 676489-50-2
Molecular Formula C27H22N6O3
Molecular Weight 478.17532 g/mol
LogP 3.81098
Topological Polar Surface Area 124.86 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 478.17532
Monoisotopic Mass 478.17532
Heavy Atoms 36
Complexity 1509.9076

Chemical Identifiers

CAS Number 676489-50-2
SMILES COC1=CN=C(C2=C1C(=CN2)C(=O)C(=O)N3CCC(=C(C#N)C4=CC=CC=C4)CC3)C5=NC=CN=C5

Product Overview

DS-003 (CAS 676489-50-2), with molecular formula C27H22N6O3 and molecular weight 478.17532 g/mol. IUPAC: 2-[1-[2-(4-methoxy-7-pyrazin-2-yl-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetyl]piperidin-4-ylidene]-2-phenylacetonitrile.

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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.
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