LY2608204 - ≥99% , Hexokinase type IV activator, CAS No.1234703-40-2, Hexokinase type IV activator

CAS: 1234703-40-2 Cat. No.: L124855 Molecular Weight: 559.81

GRADE & PURITY ≥99%

Synonyms

HY-13529 | J-690089 | J7.003C | EX-A158 | CCG-270044 | GLOBALAGLIATIN [WHO-DD] | LY2608204 | LY-2608204 | AS-75181 | SY-004 | (1R,2S)-2-cyclohexyl-1-[4-(cyclopropanesulfonyl)phenyl]-N-(5-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,3-thiazol-2-yl)cyclopropane-1

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

LY2608204 activates glucokinase (GK) with EC50 of 42 nM. Phase 2.

Specifications

Synonyms

HY-13529 | J-690089 | J7.003C | EX-A158 | CCG-270044 | GLOBALAGLIATIN [WHO-DD] | LY2608204 | LY-2608204 | AS-75181 | SY-004 | (1R, 2S)-2-cyclohexyl-1-[4-(cyclopropanesulfonyl)phenyl]-N-(5-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1, 3-thiazol-2-yl)cyclopropane-1

Specifications & Purity

≥99%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Action Type

ACTIVATOR

Mechanism of action

Hexokinase type IV activator

Purity

≥99%

Product Properties

• ALogP: 6.2

Names and Identifiers

• Canonical Smiles: C1CCC(CC1)C2CC2(C3=CC=C(C=C3)S(=O)(=O)C4CC4)C(=O)NC5=NC=C(S5)SCCN6CCCC6
• IUPAC Name: (1R,2S)-2-cyclohexyl-1-(4-cyclopropylsulfonylphenyl)-N-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3-thiazol-2-yl]cyclopropane-1-carboxamide
• InChIKey: QIIVJLHCZUTGSD-CUBQBAPOSA-N
• INCHI: 1S/C28H37N3O3S3/c32-26(30-27-29-19-25(36-27)35-17-16-31-14-4-5-15-31)28(18-24(28)20-6-2-1-3-7-20)21-8-10-22(11-9-21)37(33,34)23-12-13-23/h8-11,19-20,23-24H,1-7,12-18H2,(H,29,30,32)/t24-,28-/m0/s1
• Isomeric SMILES: C1CCC(CC1)[C@@H]2C[C@@]2(C3=CC=C(C=C3)S(=O)(=O)C4CC4)C(=O)NC5=NC=C(S5)SCCN6CCCC6
• Molecular Weight: 559.81
• Reaxy-Rn: 20420503
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20420503&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: 25°C: DMSO 112 mg/mL (200.06 mM); Water <1 mg/mL (<1 mM); Ethanol 35 mg/mL (62.52 mM)
• Molecular Weight: 559.800 g/mol
• XLogP3: 6.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 559.2 Da
• Monoisotopic Mass: 559.2 Da
• Topological Polar Surface Area: 141.000 Ų
• Heavy Atom Count: 37
• Formal Charge: 0
• Complexity: 903.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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