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CPI203

CAT: 1410-M11893-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M11893-02Size:5 mg
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Description
CPI 203 (TEN 010, JQ-2, RG-6146) is a primary amide analog of (+) -JQ1and a BET bromodomain inhibitor that shows cytotoxicity against MCL cell lines with GI50 of 0.1-0.3 uM.
CAS Number
1446144-04-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
399.897
Molecular Formula
C19H18ClN5OS
Notes
Research use only, not for human use.
Receptor
BRD4

Chemical Information

Cpi-203

a BET protein bromodomain inhibitor

CAS Number1446144-04-2
PubChem CID71291068
IUPAC Name2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]acetamide
Molecular FormulaC19H18ClN5OS
Molecular Weight399.9
XLogP2.9
Topological Polar Surface Area114
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity611
SMILES
CC1=C(SC2=C1C(=N[C@H](C3=NN=C(N32)C)CC(=O)N)C4=CC=C(C=C4)Cl)C
InChI
InChI=1S/C19H18ClN5OS/c1-9-10(2)27-19-16(9)17(12-4-6-13(20)7-5-12)22-14(8-15(21)26)18-24-23-11(3)25(18)19/h4-7,14H,8H2,1-3H3,(H2,21,26)/t14-/m0/s1
InChIKey
QECMENZMDBOLDR-AWEZNQCLSA-N
Chemical Structure
2D Structure
2D structure of Cpi-203
CAS: 1446144-04-2
CID: 71291068
Formula: C19H18ClN5OS
MW: 399.9
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.9
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass399.0920591
Monoisotopic Mass399.0920591
Topological Polar Surface Area114 Ų
Heavy Atom Count27
Formal Charge0
Complexity611
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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