L680-0113 Screening compound: 1-(4-ethylbenzenesulfonyl)-4-{[3-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine

L680-0113 Screening compound: 1-(4-ethylbenzenesulfonyl)-4-{[3-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine
L680-0113 Screening compound: 1-(4-ethylbenzenesulfonyl)-4-{[3-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L680-0113
1-(4-ethylbenzenesulfonyl)-4-{[3-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine

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

L680-0113

Molecular Formula

C25H26FN5O2S (C25 H26 FN5 O2 S)

Compound Name

1-(4-ethylbenzenesulfonyl)-4-{[3-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine

IUPAC name

1-(4-ethylbenzenesulfonyl)-4-{[3-(4-fluorophenyl)-3H-imidazo[45-b]pyridin-2-yl]methyl}piperazine

SMILES

CCc(cc1)ccc1S(N1CCN(Cc(n2-c(cc3)ccc3F)nc3c2nccc3)CC1)(=O)=O

InChI

InChI=1S/C25H26FN5O2S/c1-2-19-5-11-22(12-6-19)34(32,33)30-16-14-29(15-17-30)18-24-28-23-4-3-13-27-25(23)31(24)21-9-7-20(26)8-10-21/h3-13H,2,14-18H2,1H3

InChI Key

NVIPBPBMPIBSCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15133217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.897

Distribution Coefficient, logD

3.895

Water Solubility, LogSw

-3.84

Polar Surface Area

57.045

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

4.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

L680-0113 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

PI3K-Targeted Library (17255 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Proteases
  • GPCR
  • Ion Channels
  • Kinases

References: we are preparing a list of scientific research reports with L680-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L680-0113?
Check Price and Availability of L680-0113, 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 L680-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L680-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L680-0113
  • 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 L680-0113 available by request