K823-2583 Screening compound: N-[(2-chlorophenyl)methyl]-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

K823-2583 Screening compound: N-[(2-chlorophenyl)methyl]-5-methyl-3-[2-(morpholin-4-yl)-2-oxoethyl]-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
K823-2583 Screening compound: N-[(2-chlorophenyl)methyl]-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 K823-2583
N-[(2-chlorophenyl)methyl]-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

K823-2583

Molecular Formula

C21H21ClN4O4S (C21 H21 ClN4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(C(NCc(cccc2)c2Cl)=O)sc(N=CN2CC(N3CCOCC3)=O)c1C2=O

InChI

InChI=1S/C21H21ClN4O4S/c1-13-17-20(31-18(13)19(28)23-10-14-4-2-3-5-15(14)22)24-12-26(21(17)29)11-16(27)25-6-8-30-9-7-25/h2-5,12H,6-11H2,1H3,(H,23,28)

InChI Key

HUGHMOKSMDXHNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04422203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.94

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.573

Distribution Coefficient, logD

1.573

Water Solubility, LogSw

-2.90

Polar Surface Area

74.956

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

K823-2583 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • Kinases
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K823-2583 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K823-2583?
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What is the minimum amount of K823-2583 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K823-2583
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K823-2583
  • 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 K823-2583 available by request