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IP-DNQ

CAT: 0013-GTR19273272-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19273272-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
IP-DNQ is a potent NQO1-dependent cytotoxin. It exhibits strong cytotoxic activity against MCF-7 cells, with an IC50 of 0.18 μM. This compound is applicable for cancer research.
CAS Number
1430798-23-4
Smiles
O=C1C=C (C=2C (=O) C=3C (=CC (=O) N (C3C (=O) C2N1) CCC (C) C) C) C
Molecular Formula
C19H20N2O4
Molecular Weight
340.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4,6-dimethyl-1-(3-methylbutyl)-9H-pyrido[3,2-g]quinoline-2,5,8,10-tetrone
CAS Number1430798-23-4
PubChem CID89510042
IUPAC Name4,6-dimethyl-1-(3-methylbutyl)-9H-pyrido[3,2-g]quinoline-2,5,8,10-tetrone
Molecular FormulaC19H20N2O4
Molecular Weight340.4
XLogP1
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity853
SMILES
CC1=CC(=O)NC2=C1C(=O)C3=C(C2=O)N(C(=O)C=C3C)CCC(C)C
InChI
InChI=1S/C19H20N2O4/c1-9(2)5-6-21-13(23)8-11(4)15-17(21)19(25)16-14(18(15)24)10(3)7-12(22)20-16/h7-9H,5-6H2,1-4H3,(H,20,22)
InChIKey
KSDAYRXQDULQPE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,6-dimethyl-1-(3-methylbutyl)-9H-pyrido[3,2-g]quinoline-2,5,8,10-tetrone
CAS: 1430798-23-4
CID: 89510042
Formula: C19H20N2O4
MW: 340.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight340.4
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass340.14230712
Monoisotopic Mass340.14230712
Topological Polar Surface Area83.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity853
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

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