TTP 22

CAT: 0931-T1828-03Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No

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CAT#:0931-T1828-03Size:1 mL - 10 mM (in DMSO)

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

329907-28-0

Target

Casein Kinase

Related Pathways

Stem Cells, Metabolism

Purity

0.9778

Bioactivity

TTP 22 is a high affinity, ATP-competitive casein kinase 2 (CK2) inhibitor with IC50/Ki of 0.1 uM/40 nM, and shows selectivity >250-fold for CK2 over JNK3, ROCK1, and MET (IC50> 10 uM) .

Smiles

Cc1ccc(cc1)-c1csc2ncnc(SCCC(O)=O)c12

Molecular Formula

C16H14N2O2S2

Molecular Weight

330.42

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Ttp 22

CAS Number	329907-28-0
PubChem CID	1536915
IUPAC Name	3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid
Molecular Formula	C16H14N2O2S2
Molecular Weight	330.4
XLogP	3.9
Topological Polar Surface Area	117
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Heavy Atom Count	22
Formal Charge	0
Complexity	388

SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCCC(=O)O

InChI

InChI=1S/C16H14N2O2S2/c1-10-2-4-11(5-3-10)12-8-22-16-14(12)15(17-9-18-16)21-7-6-13(19)20/h2-5,8-9H,6-7H2,1H3,(H,19,20)

InChIKey

RAOULLCLLOGTDA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 329907-28-0

CID: 1536915

Formula: C16H14N2O2S2

MW: 330.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	330.4
XLogP3	3.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	330.04967004
Monoisotopic Mass	330.04967004
Topological Polar Surface Area	117 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	388
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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TTP 22

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