Products for Research Use Only
RegisterLogin

IWP-2

CAT: 0127-BUP10526-05Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BUP10526-05Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
686770-61-6
Synonyms
IWP2
MDL Number
MFCD04457599
Purity
=95%
Smiles
Cc1ccc2nc(NC(=O)CSc3nc4CCSc4c(=O)n3-c3ccccc3)sc2c1

Chemical Information

Iwp-2

IWP-2 is a thienopyridine that is 6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one substituted by {2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanediyl and phenyl groups at positions 2 and 3, respectively. It is an ATP-competitive CK1delta inhibitor and also a Wnt/beta-catenin signal pathway inhibitor. It has a role as an EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor and a Wnt signalling inhibitor. It is a secondary carboxamide, an organic sulfide, a member of benzenes, a thienopyridine and a member of benzothiazoles.

CAS Number686770-61-6
PubChem CID2155128
IUPAC NameN-(6-methyl-1,3-benzothiazol-2-yl)-2-[(4-oxo-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Molecular FormulaC22H18N4O2S3
Molecular Weight466.6
XLogP4.8
Topological Polar Surface Area154
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity796
SMILES
CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=CC=C5)SCC4
InChI
InChI=1S/C22H18N4O2S3/c1-13-7-8-15-17(11-13)31-21(23-15)25-18(27)12-30-22-24-16-9-10-29-19(16)20(28)26(22)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,23,25,27)
InChIKey
WRKPZSMRWPJJDH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Iwp-2
CAS: 686770-61-6
CID: 2155128
Formula: C22H18N4O2S3
MW: 466.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight466.6
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass466.05918935
Monoisotopic Mass466.05918935
Topological Polar Surface Area154 Ų
Heavy Atom Count31
Formal Charge0
Complexity796
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

Related Products

CatalogName
BUP01632-01IWP-4
BUP02679-01IWP-3
BUP13381-01IWP L6
BUP01238-01IWP 12
BUP09911-01IWP-O1
PC1003049-012,2,2-Trifluoroethyl 2,2,2-trichloroacetate
PC32719-012,2,2,2'-Tetrafluoroacetophenone
OR1009873-012,2,2,2-Ethylenedinitrilotetraethanol
PC450293-012,2-Difluoroethyl 2,2,2-trifluoroethyl carbonate
PC100568-012,2,2-Trifluoroethyl 2-cyanoacetate

Alternative Products

CatalogName
HY-13912-01IWP-2
3533/50IWP 2

Popular Products