Products for Research Use Only

Graveoline

CAT: 0013-GTR19155990-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155990-01Size:100 mg
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Description
Graveoline is an apoptosis and autophagy inducer in skin melanoma cancer cells.
CAS Number
485-61-0
Product Name Alternative
2- (Benzo[d][1,3]dioxol-5-yl) -1-methylquinolin-4 (1H) -one | Foliosine
Purity
>98% (HPLC)
Solubility
DMSO:10 mM
Smiles
CN1C2=CC=CC=C2C (=O) C=C1C3=CC4=C (C=C3) OCO4
Molecular Formula
C17H13NO3
Molecular Weight
279.29
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Graveoline

Graveoline is a member of quinolines.

CAS Number485-61-0
PubChem CID353825
IUPAC Name2-(1,3-benzodioxol-5-yl)-1-methylquinolin-4-one
Molecular FormulaC17H13NO3
Molecular Weight279.29
XLogP3.1
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity461
SMILES
CN1C2=CC=CC=C2C(=O)C=C1C3=CC4=C(C=C3)OCO4
InChI
InChI=1S/C17H13NO3/c1-18-13-5-3-2-4-12(13)15(19)9-14(18)11-6-7-16-17(8-11)21-10-20-16/h2-9H,10H2,1H3
InChIKey
COBBNRKBTCBWQP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Graveoline
CAS: 485-61-0
CID: 353825
Formula: C17H13NO3
MW: 279.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight279.29
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass279.08954328
Monoisotopic Mass279.08954328
Topological Polar Surface Area38.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity461
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes