G664-0543 Screening compound: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}thieno[2,3-b]pyridine-2-carboxamide

G664-0543 Screening compound: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}thieno[2,3-b]pyridine-2-carboxamide
G664-0543 Screening compound: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G664-0543
3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}thieno[2,3-b]pyridine-2-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

G664-0543

Molecular Formula

C23H23N3OS2 (C23 H23 N3 OS2)

Compound Name

3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

3-(25-dimethyl-1H-pyrrol-1-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}thieno[23-b]pyridine-2-carboxamide

SMILES

Cc1ccc(C)n1-c1c(C(NCCc(cc2)ccc2SC)=O)sc2ncccc12

InChI

InChI=1S/C23H23N3OS2/c1-15-6-7-16(2)26(15)20-19-5-4-13-25-23(19)29-21(20)22(27)24-14-12-17-8-10-18(28-3)11-9-17/h4-11,13H,12,14H2,1-3H3,(H,24,27)

InChI Key

OCAHJXJLRIWRAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15027397

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.595

Distribution Coefficient, logD

4.594

Water Solubility, LogSw

-4.23

Polar Surface Area

36.933

Acid Dissociation Constant (pKa)

16.04

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

G664-0543 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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 G664-0543 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G664-0543?
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What is the minimum amount of G664-0543 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G664-0543
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G664-0543
  • 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 G664-0543 available by request