L697-0564 Screening compound: 1-{[1-({5-[(1E)-2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}piperidine

L697-0564 Screening compound: 1-{[1-({5-[(1E)-2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}piperidine
L697-0564 Screening compound: 1-{[1-({5-[(1E)-2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound L697-0564
1-{[1-({5-[(1E)-2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}piperidine

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

L697-0564

Molecular Formula

C19H20ClN5O3S (C19 H20 ClN5 O3 S)

Compound Name

1-{[1-({5-[(1E)-2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}piperidine

IUPAC name

1-{[1-({5-[(1E)-2-(2-chlorophenyl)ethenyl]-124-oxadiazol-3-yl}methyl)-1H-imidazol-4-yl]sulfonyl}piperidine

SMILES

O=S(c1cn(Cc2noc(/C=C/c(cccc3)c3Cl)n2)cn1)(N1CCCCC1)=O

InChI

InChI=1S/C19H20ClN5O3S/c20-16-7-3-2-6-15(16)8-9-18-22-17(23-28-18)12-24-13-19(21-14-24)29(26,27)25-10-4-1-5-11-25/h2-3,6-9,13-14H,1,4-5,10-12H2

InChI Key

DBCKQNLWGNBAHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470584

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.92

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.430

Distribution Coefficient, logD

3.430

Water Solubility, LogSw

-3.45

Polar Surface Area

76.121

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

2.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

L697-0564 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L697-0564 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L697-0564?
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What is the minimum amount of L697-0564 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L697-0564
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L697-0564
  • 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 L697-0564 available by request