L097-0562 Screening compound: 1-(5-chloro-2-methylphenyl)-4-[2-(pyridin-4-yl)-1,3-thiazole-4-carbonyl]piperazine

L097-0562 Screening compound: 1-(5-chloro-2-methylphenyl)-4-[2-(pyridin-4-yl)-1,3-thiazole-4-carbonyl]piperazine
L097-0562 Screening compound: 1-(5-chloro-2-methylphenyl)-4-[2-(pyridin-4-yl)-1,3-thiazole-4-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L097-0562
1-(5-chloro-2-methylphenyl)-4-[2-(pyridin-4-yl)-1,3-thiazole-4-carbonyl]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

L097-0562

Molecular Formula

C20H19ClN4OS (C20 H19 ClN4 OS)

Compound Name

1-(5-chloro-2-methylphenyl)-4-[2-(pyridin-4-yl)-1,3-thiazole-4-carbonyl]piperazine

IUPAC name

1-(5-chloro-2-methylphenyl)-4-[2-(pyridin-4-yl)-13-thiazole-4-carbonyl]piperazine

SMILES

Cc(ccc(Cl)c1)c1N(CC1)CCN1C(c1csc(-c2ccncc2)n1)=O

InChI

InChI=1S/C20H19ClN4OS/c1-14-2-3-16(21)12-18(14)24-8-10-25(11-9-24)20(26)17-13-27-19(23-17)15-4-6-22-7-5-15/h2-7,12-13H,8-11H2,1H3

InChI Key

VCALRMREOIIYEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27232095

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.92

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.216

Distribution Coefficient, logD

4.215

Water Solubility, LogSw

-4.51

Polar Surface Area

39.008

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

4.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

L097-0562 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

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

CNS BBB Library (22607 compounds)

CORONAVIRUS Library (20774 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with L097-0562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L097-0562?
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What is the minimum amount of L097-0562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L097-0562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L097-0562
  • 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 L097-0562 available by request