T494-1018 Screening compound: 2-(2-chloro-6-fluorophenyl)-1-{2,3-dimethyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridin-5-yl}ethan-1-one

T494-1018 Screening compound: 2-(2-chloro-6-fluorophenyl)-1-{2,3-dimethyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridin-5-yl}ethan-1-one
T494-1018 Screening compound: 2-(2-chloro-6-fluorophenyl)-1-{2,3-dimethyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridin-5-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T494-1018
2-(2-chloro-6-fluorophenyl)-1-{2,3-dimethyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridin-5-yl}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

T494-1018

Molecular Formula

C16H17ClFN3O (C16 H17 ClFN3 O)

Compound Name

2-(2-chloro-6-fluorophenyl)-1-{2,3-dimethyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridin-5-yl}ethan-1-one

IUPAC name

2-(2-chloro-6-fluorophenyl)-1-{23-dimethyl-3H4H5H6H7H-imidazo[45-c]pyridin-5-yl}ethan-1-one

SMILES

Cc1nc(CCN(C2)C(Cc(c(F)ccc3)c3Cl)=O)c2n1C

InChI

InChI=1S/C16H17ClFN3O/c1-10-19-14-6-7-21(9-15(14)20(10)2)16(22)8-11-12(17)4-3-5-13(11)18/h3-5H,6-9H2,1-2H3

InChI Key

WGPYJAWRHDRPJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27621953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.78

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.965

Distribution Coefficient, logD

0.911

Water Solubility, LogSw

-2.71

Polar Surface Area

29.804

Acid Dissociation Constant (pKa)

17.36

Base Dissociation Constant (pKb)

8.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

T494-1018 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Bromodomain Modulators Library (5801 compounds)

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Nervous system
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with T494-1018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T494-1018?
Check Price and Availability of T494-1018, 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 T494-1018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T494-1018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T494-1018
  • 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 T494-1018 available by request