G664-0549 Screening compound: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide

G664-0549 Screening compound: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
G664-0549 Screening compound: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G664-0549
3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-[(2-methylphenyl)methyl]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

G664-0549

Molecular Formula

C22H21N3OS (C22 H21 N3 OS)

Compound Name

3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

3-(25-dimethyl-1H-pyrrol-1-yl)-N-[(2-methylphenyl)methyl]thieno[23-b]pyridine-2-carboxamide

SMILES

Cc1ccc(C)n1-c1c(C(NCc2c(C)cccc2)=O)sc2ncccc12

InChI

InChI=1S/C22H21N3OS/c1-14-7-4-5-8-17(14)13-24-21(26)20-19(25-15(2)10-11-16(25)3)18-9-6-12-23-22(18)27-20/h4-12H,13H2,1-3H3,(H,24,26)

InChI Key

MKTDJUKRJNSFMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15027399

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.831

Distribution Coefficient, logD

4.830

Water Solubility, LogSw

-4.73

Polar Surface Area

37.091

Acid Dissociation Constant (pKa)

13.96

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

G664-0549 in Drug Discovery

Included in Screening Libraries

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G664-0549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G664-0549?
Check Price and Availability of G664-0549, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G664-0549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G664-0549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G664-0549
  • 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 G664-0549 available by request