K263-0623 Screening compound: ({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl cyanide

K263-0623 Screening compound: ({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl cyanide
K263-0623 Screening compound: ({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound K263-0623
({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl cyanide

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

K263-0623

Molecular Formula

C22H16N4OS2 (C22 H16 N4 OS2)

Compound Name

({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl cyanide

IUPAC name

2-({5-[2-(1H-indol-3-yl)ethyl]-6-oxo-8-thia-35-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)31012-pentaen-4-yl}sulfanyl)acetonitrile

SMILES

N#CCSC(N(CCc1c[nH]c2c1cccc2)C1=O)=Nc2c1sc1c2cccc1

InChI

InChI=1S/C22H16N4OS2/c23-10-12-28-22-25-19-16-6-2-4-8-18(16)29-20(19)21(27)26(22)11-9-14-13-24-17-7-3-1-5-15(14)17/h1-8,13,24H,9,11-12H2

InChI Key

PNPNPJFBKNWSKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15085566

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.326

Distribution Coefficient, logD

4.326

Water Solubility, LogSw

-4.27

Polar Surface Area

51.878

Acid Dissociation Constant (pKa)

18.49

Base Dissociation Constant (pKb)

-1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with K263-0623 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K263-0623?
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What is the minimum amount of K263-0623 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K263-0623
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K263-0623
  • 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 K263-0623 available by request