L680-0418 Screening compound: 2-({4-[(5-CHLORO-2-THIENYL)SULFONYL]PIPERAZINO}METHYL)-3-(3-FLUOROPHENYL)-3H-IMIDAZO[4,5-B]PYRIDINE

L680-0418 Screening compound: 2-({4-[(5-CHLORO-2-THIENYL)SULFONYL]PIPERAZINO}METHYL)-3-(3-FLUOROPHENYL)-3H-IMIDAZO[4,5-B]PYRIDINE
L680-0418 Screening compound: 2-({4-[(5-CHLORO-2-THIENYL)SULFONYL]PIPERAZINO}METHYL)-3-(3-FLUOROPHENYL)-3H-IMIDAZO[4,5-B]PYRIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound L680-0418
2-({4-[(5-CHLORO-2-THIENYL)SULFONYL]PIPERAZINO}METHYL)-3-(3-FLUOROPHENYL)-3H-IMIDAZO[4,5-B]PYRIDINE

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

L680-0418

Molecular Formula

C21H19ClFN5O2S2 (C21 H19 ClFN5 O2 S2)

Compound Name

2-({4-[(5-CHLORO-2-THIENYL)SULFONYL]PIPERAZINO}METHYL)-3-(3-FLUOROPHENYL)-3H-IMIDAZO[4,5-B]PYRIDINE

IUPAC name

n/a

SMILES

O=S(c(s1)ccc1Cl)(N1CCN(Cc(n2-c3cc(F)ccc3)nc3c2nccc3)CC1)=O

InChI

InChI=1S/C21H19ClFN5O2S2/c22-18-6-7-20(31-18)32(29,30)27-11-9-26(10-12-27)14-19-25-17-5-2-8-24-21(17)28(19)16-4-1-3-15(23)13-16/h1-8,13H,9-12,14H2

InChI Key

MCHSRARPFJUPOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15133276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492

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

3.364

Distribution Coefficient, logD

3.363

Water Solubility, LogSw

-3.56

Polar Surface Area

58.063

Acid Dissociation Constant (pKa)

28.52

Base Dissociation Constant (pKb)

4.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

L680-0418 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L680-0418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L680-0418?
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What is the minimum amount of L680-0418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L680-0418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L680-0418
  • 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 L680-0418 available by request