L680-0336 Screening compound: 1-(3,4-dimethylbenzenesulfonyl)-4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine

L680-0336 Screening compound: 1-(3,4-dimethylbenzenesulfonyl)-4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine
L680-0336 Screening compound: 1-(3,4-dimethylbenzenesulfonyl)-4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L680-0336
1-(3,4-dimethylbenzenesulfonyl)-4-{[3-(3-methylphenyl)-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

L680-0336

Molecular Formula

C26H29N5O2S (C26 H29 N5 O2 S)

Compound Name

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

IUPAC name

1-(34-dimethylbenzenesulfonyl)-4-{[3-(3-methylphenyl)-3H-imidazo[45-b]pyridin-2-yl]methyl}piperazine

SMILES

Cc1cccc(-n2c(nccc3)c3nc2CN(CC2)CCN2S(c2cc(C)c(C)cc2)(=O)=O)c1

InChI

InChI=1S/C26H29N5O2S/c1-19-6-4-7-22(16-19)31-25(28-24-8-5-11-27-26(24)31)18-29-12-14-30(15-13-29)34(32,33)23-10-9-20(2)21(3)17-23/h4-11,16-17H,12-15,18H2,1-3H3

InChI Key

FNOBHKVQKBVVFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15133254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.430

Distribution Coefficient, logD

4.422

Water Solubility, LogSw

-4.21

Polar Surface Area

57.045

Acid Dissociation Constant (pKa)

28.07

Base Dissociation Constant (pKb)

5.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

L680-0336 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

PI3K-Targeted Library (17255 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L680-0336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L680-0336?
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What is the minimum amount of L680-0336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L680-0336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L680-0336
  • 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 L680-0336 available by request