L453-0608 Screening compound: 1-(2-chlorophenyl)-3-methyl-3-(2-{5-[4-(piperidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)urea

L453-0608 Screening compound: 1-(2-chlorophenyl)-3-methyl-3-(2-{5-[4-(piperidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)urea
L453-0608 Screening compound: 1-(2-chlorophenyl)-3-methyl-3-(2-{5-[4-(piperidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L453-0608
1-(2-chlorophenyl)-3-methyl-3-(2-{5-[4-(piperidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)urea

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

L453-0608

Molecular Formula

C24H26ClN5O3 (C24 H26 ClN5 O3)

Compound Name

1-(2-chlorophenyl)-3-methyl-3-(2-{5-[4-(piperidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl}ethyl)urea

IUPAC name

1-(2-chlorophenyl)-3-methyl-3-(2-{5-[4-(piperidine-1-carbonyl)phenyl]-124-oxadiazol-3-yl}ethyl)urea

SMILES

CN(CCc1noc(-c(cc2)ccc2C(N2CCCCC2)=O)n1)C(Nc(cccc1)c1Cl)=O

InChI

InChI=1S/C24H26ClN5O3/c1-29(24(32)26-20-8-4-3-7-19(20)25)16-13-21-27-22(33-28-21)17-9-11-18(12-10-17)23(31)30-14-5-2-6-15-30/h3-4,7-12H,2,5-6,13-16H2,1H3,(H,26,32)

InChI Key

RHCUUPOMZYXAPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27253238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.785

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.14

Polar Surface Area

73.806

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L453-0608 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L453-0608 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L453-0608?
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What is the minimum amount of L453-0608 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L453-0608
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L453-0608
  • 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 L453-0608 available by request