8013-6422 Screening compound: 6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde

8013-6422 Screening compound: 6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
8013-6422 Screening compound: 6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-6422
6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde

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

8013-6422

Molecular Formula

C13H10N2O2S (C13 H10 N2 O2 S)

Compound Name

6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde

IUPAC name

6-(4-methoxyphenyl)imidazo[21-b][13]thiazole-5-carbaldehyde

SMILES

COc(cc1)ccc1-c1c(C=O)n(ccs2)c2n1

InChI

InChI=1S/C13H10N2O2S/c1-17-10-4-2-9(3-5-10)12-11(8-16)15-6-7-18-13(15)14-12/h2-8H,1H3

InChI Key

XIUVRKVRWODYRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02661620

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.759

Distribution Coefficient, logD

2.759

Water Solubility, LogSw

-2.98

Polar Surface Area

31.533

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

1.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

8013-6422 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8013-6422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-6422?
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What is the minimum amount of 8013-6422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-6422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-6422
  • 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 8013-6422 available by request