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ADT-007

CAT: 0957-E1969-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-E1969-02Size:25 mg
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Description
ADT-007 is a potent and orally active pan-RAS inhibitor. ADT-007 effectively targets and suppresses the proliferation of cancer cells harboring mutated or hyper-activated wild-type RAS isozymes. ADT-007 exhibits potent anti-cancer effects.
CAS Number
1945941-09-2
Target
Ras
Activity
Apoptosis
Molecular Formula
C26H24FNO5

Chemical Information

2-[(3Z)-6-fluoro-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-methylinden-1-yl]-N-(furan-2-ylmethyl)acetamide
CAS Number1945941-09-2
PubChem CID121393631
IUPAC Name2-[(3Z)-6-fluoro-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-methylinden-1-yl]-N-(furan-2-ylmethyl)acetamide
Molecular FormulaC26H24FNO5
Molecular Weight449.5
XLogP3.3
Topological Polar Surface Area80.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity754
SMILES
CC\1=C(C2=C(/C1=C\C3=CC(=C(C(=C3)OC)O)OC)C=CC(=C2)F)CC(=O)NCC4=CC=CO4
InChI
InChI=1S/C26H24FNO5/c1-15-20(9-16-10-23(31-2)26(30)24(11-16)32-3)19-7-6-17(27)12-22(19)21(15)13-25(29)28-14-18-5-4-8-33-18/h4-12,30H,13-14H2,1-3H3,(H,28,29)/b20-9-
InChIKey
CJBUOVAXMPVXFB-UKWGHVSLSA-N
Chemical Structure
2D Structure
2D structure of 2-[(3Z)-6-fluoro-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-2-methylinden-1-yl]-N-(furan-2-ylmethyl)acetamide
CAS: 1945941-09-2
CID: 121393631
Formula: C26H24FNO5
MW: 449.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight449.5
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass449.16385103
Monoisotopic Mass449.16385103
Topological Polar Surface Area80.9 Ų
Heavy Atom Count33
Formal Charge0
Complexity754
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes