E643-1912 Screening compound: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}ethan-1-one

E643-1912 Screening compound: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}ethan-1-one
E643-1912 Screening compound: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-1912
1-(1,2-dimethyl-1H-indol-3-yl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}ethan-1-one

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

E643-1912

Molecular Formula

C18H16N4OS (C18 H16 N4 OS)

Compound Name

1-(1,2-dimethyl-1H-indol-3-yl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}ethan-1-one

IUPAC name

1-(12-dimethyl-1H-indol-3-yl)-2-{3H-imidazo[45-b]pyridin-2-ylsulfanyl}ethan-1-one

SMILES

Cc1c(C(CSc([nH]2)nc3c2nccc3)=O)c(cccc2)c2n1C

InChI

InChI=1S/C18H16N4OS/c1-11-16(12-6-3-4-8-14(12)22(11)2)15(23)10-24-18-20-13-7-5-9-19-17(13)21-18/h3-9H,10H2,1-2H3,(H,19,20,21)

InChI Key

VNZKISAMYIOHAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907241

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.472

Distribution Coefficient, logD

2.464

Water Solubility, LogSw

-2.63

Polar Surface Area

43.883

Acid Dissociation Constant (pKa)

11.68

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

E643-1912 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Epigenetics Focused Set (26518 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with E643-1912 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-1912?
Check Price and Availability of E643-1912, 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 E643-1912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-1912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-1912
  • 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 E643-1912 available by request