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CTPB

CAT: 0804-HY-124960-02Size: 10 mM - 1 mLDry Ice: NoHazardous: No
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CAT#:0804-HY-124960-02Size:10 mM - 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CTPB is a good activator of p300 histone acetyl transferase (HAT) enzyme[1].
CAS Number
586976-24-1
UNSPSC
12352005
Hazard Statement
H302, H315, H319
Target
Histone Acetyltransferase
Type
Reference compound
Related Pathways
Epigenetics
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/CTPB.html
Purity
99.0
Solubility
DMSO : 62.5 mg/mL (ultrasonic)
Smiles
O=C(NC1=CC=C(Cl)C(C(F)(F)F)=C1)C2=C(CCCCCCCCCCCCCCC)C=CC=C2OCC
Molecular Formula
C31H43ClF3NO2
Molecular Weight
554.13
Precautions
H302, H315, H319
References & Citations
[1]Sivanandam M, et al. Investigation of activation mechanism and conformational stability of N- (4-chloro-3-trifluoromethyl-phenyl) -2-ethoxybenzamide and N- (4-chloro-3-trifluoromethyl-phenyl) -2-ethoxy-6-pentadecyl-benzamidein the active site of p300 histone acetyl transferase enzyme by molecular dynamics and binding free-energy studies. J Biomol Struct Dyn. 2018 Oct 9:1-38.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
CBP/p300

Chemical Information

Ctpb

CTPB is a benzamide obtained by formal condensation of the carboxy group of 2-ethoxy-6-pentadecylbenzoic acid with one of the amino groups of 4-chloro-3-(trifluoromethyl)aniline. It has a role as a histone acetyltransferase activator. It is a member of benzamides, an aromatic ether, an organofluorine compound and a member of monochlorobenzenes.

CAS Number586976-24-1
PubChem CID10311918
IUPAC NameN-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxy-6-pentadecylbenzamide
Molecular FormulaC31H43ClF3NO2
Molecular Weight554.1
XLogP12.4
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count18
Heavy Atom Count38
Formal Charge0
Complexity633
SMILES
CCCCCCCCCCCCCCCC1=C(C(=CC=C1)OCC)C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F
InChI
InChI=1S/C31H43ClF3NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-24-19-17-20-28(38-4-2)29(24)30(37)36-25-21-22-27(32)26(23-25)31(33,34)35/h17,19-23H,3-16,18H2,1-2H3,(H,36,37)
InChIKey
OYBMVMAXKOGYDC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ctpb
CAS: 586976-24-1
CID: 10311918
Formula: C31H43ClF3NO2
MW: 554.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight554.1
XLogP312.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count18
Exact Mass553.2934418
Monoisotopic Mass553.2934418
Topological Polar Surface Area38.3 Ų
Heavy Atom Count38
Formal Charge0
Complexity633
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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