K823-1966 Screening compound: N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide

K823-1966 Screening compound: N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide
K823-1966 Screening compound: N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K823-1966
N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]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

K823-1966

Molecular Formula

C25H25BrN6OS (C25 H25 BrN6 OS)

Compound Name

N-(2-bromo-4-methylphenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

N-(2-bromo-4-methylphenyl)-25-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[23-d]pyrimidine-6-carboxamide

SMILES

Cc1c(C(Nc(ccc(C)c2)c2Br)=O)sc2c1c(N(CC1)CCN1c1ncccc1)nc(C)n2

InChI

InChI=1S/C25H25BrN6OS/c1-15-7-8-19(18(26)14-15)30-24(33)22-16(2)21-23(28-17(3)29-25(21)34-22)32-12-10-31(11-13-32)20-6-4-5-9-27-20/h4-9,14H,10-13H2,1-3H3,(H,30,33)

InChI Key

JWIALNOVJODQPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15109687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.106

Distribution Coefficient, logD

6.075

Water Solubility, LogSw

-5.75

Polar Surface Area

57.078

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

6.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

K823-1966 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K823-1966 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K823-1966?
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What is the minimum amount of K823-1966 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K823-1966
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K823-1966
  • 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 K823-1966 available by request