KY02111 - ≥98% , CAS No.1118807-13-8

CAS: 1118807-13-8 Cat. No.: K129803 Molecular Weight: 376.86 EC Number: 808-505-5

GRADE & PURITY ≥98%

Synonyms

EN300-1266069 | UNII-6AXH36YF6M | AS-16445 | DTXSID80429194 | MFCD08483062 | KY02111 | KY-02111 | UNII-A4125MQ8RX | 2-(3-(3,4-Dimethoxyphenyl)propanamido)-6-chlorobenzothiazole | S7096 | AM81229 | C18H17ClN2O3S | N-(6-Chloro-benzothiazol-2-yl)-3-(3,4-dime

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

KY02111 promotes differentiation of hPSCs to cardiomyocytes by inhibiting Wnt signaling, may act downstream of APC and GSK3β.
A Wnt inhibitor.

Specifications

Synonyms

EN300-1266069 | UNII-6AXH36YF6M | AS-16445 | DTXSID80429194 | MFCD08483062 | KY02111 | KY-02111 | UNII-A4125MQ8RX | 2-(3-(3, 4-Dimethoxyphenyl)propanamido)-6-chlorobenzothiazole | S7096 | AM81229 | C18H17ClN2O3S | N-(6-Chloro-benzothiazol-2-yl)-3-(3, 4-dime

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

KY02111 promotes differentiation of human pluripotent stem cells (hPSCs) to cardiomyocytes by inhibiting WNT signaling in hPSCs in a manner that is distinct from that of previously studied WNT inhibitors. The substantial (98%) differentiation of hPSCs to

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: COC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)OC
• IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)propanamide
• InChIKey: LXFKEVQQSKQXPR-UHFFFAOYSA-N
• INCHI: 1S/C18H17ClN2O3S/c1-23-14-7-3-11(9-15(14)24-2)4-8-17(22)21-18-20-13-6-5-12(19)10-16(13)25-18/h3,5-7,9-10H,4,8H2,1-2H3,(H,20,21,22)
• Isomeric SMILES: COC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)OC
• WGK Germany: 3
• Molecular Weight: 376.86
• Reaxy-Rn: 23763295
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23763295&ln=

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: DMSO 75 mg/mL Water Ethanol
• Molecular Weight: 376.900 g/mol
• XLogP3: 4.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 376.065 Da
• Monoisotopic Mass: 376.065 Da
• Topological Polar Surface Area: 88.700 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 456.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1