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Bcl-2/Mcl-1-IN-2

CAT: 0013-GTR19186158-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19186158-01Size:25 mg
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Description
Bcl-2/Mcl-1-IN-2 is a dual inhibitor of Bcl-2 (Ki=4.70 μM) and Mcl-1 (Ki=0.88 μM) . This small molecule is a research tool for studying apoptosis mechanisms and has been utilized in both in vitro and in vivo cancer research models to investigate therapeutic strategies.
CAS Number
2673361-07-2
Field of Research
Cell Biology
Smiles
C (CCOC1=CC (C) =C (Cl) C (C) =C1) N2C=3C (=C (C=CC3) C4=C (C (O) =O) C=CC=C4) C=C2
Molecular Formula
C26H24ClNO3
Molecular Weight
433.93
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bcl-2/Mcl-1-IN-2
CAS Number2673361-07-2
PubChem CID163196396
IUPAC Name2-[1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]indol-4-yl]benzoic acid
Molecular FormulaC26H24ClNO3
Molecular Weight433.9
XLogP6.5
Topological Polar Surface Area51.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count31
Formal Charge0
Complexity589
SMILES
CC1=CC(=CC(=C1Cl)C)OCCCN2C=CC3=C(C=CC=C32)C4=CC=CC=C4C(=O)O
InChI
InChI=1S/C26H24ClNO3/c1-17-15-19(16-18(2)25(17)27)31-14-6-12-28-13-11-22-20(9-5-10-24(22)28)21-7-3-4-8-23(21)26(29)30/h3-5,7-11,13,15-16H,6,12,14H2,1-2H3,(H,29,30)
InChIKey
WVQDCJUWBRZUKS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bcl-2/Mcl-1-IN-2
CAS: 2673361-07-2
CID: 163196396
Formula: C26H24ClNO3
MW: 433.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.9
XLogP36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass433.1444713
Monoisotopic Mass433.1444713
Topological Polar Surface Area51.5 Ų
Heavy Atom Count31
Formal Charge0
Complexity589
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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