K823-2537 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

K823-2537 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
K823-2537 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K823-2537
N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

K823-2537

Molecular Formula

C22H23ClN4O6S (C22 H23 ClN4 O6 S)

Compound Name

N-(5-chloro-2,4-dimethoxyphenyl)-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

N-(5-chloro-24-dimethoxyphenyl)-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carboxamide

SMILES

Cc1c(C(Nc(c(OC)c2)cc(Cl)c2OC)=O)sc(N=CN2CC(N3CCOCC3)=O)c1C2=O

InChI

InChI=1S/C22H23ClN4O6S/c1-12-18-21(24-11-27(22(18)30)10-17(28)26-4-6-33-7-5-26)34-19(12)20(29)25-14-8-13(23)15(31-2)9-16(14)32-3/h8-9,11H,4-7,10H2,1-3H3,(H,25,29)

InChI Key

SETFLKYGDHDFDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15109741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.97

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.491

Distribution Coefficient, logD

0.497

Water Solubility, LogSw

-3.06

Polar Surface Area

88.196

Acid Dissociation Constant (pKa)

6.45

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

K823-2537 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K823-2537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K823-2537?
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What is the minimum amount of K823-2537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K823-2537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K823-2537
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of K823-2537 available by request