L453-0296 Screening compound: N-[2-(furan-2-yl)ethyl]-4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide

L453-0296 Screening compound: N-[2-(furan-2-yl)ethyl]-4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide
L453-0296 Screening compound: N-[2-(furan-2-yl)ethyl]-4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L453-0296
N-[2-(furan-2-yl)ethyl]-4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide

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

L453-0296

Molecular Formula

C26H27N5O5 (C26 H27 N5 O5)

Compound Name

N-[2-(furan-2-yl)ethyl]-4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide

IUPAC name

N-[2-(furan-2-yl)ethyl]-4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-124-oxadiazol-5-yl]benzamide

SMILES

CN(CCc1noc(-c(cc2)ccc2C(NCCc2ccco2)=O)n1)C(Nc(cccc1)c1OC)=O

InChI

InChI=1S/C26H27N5O5/c1-31(26(33)28-21-7-3-4-8-22(21)34-2)16-14-23-29-25(36-30-23)19-11-9-18(10-12-19)24(32)27-15-13-20-6-5-17-35-20/h3-12,17H,13-16H2,1-2H3,(H,27,32)(H,28,33)

InChI Key

DFIONLIANPYMLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15127837

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.568

Distribution Coefficient, logD

3.568

Water Solubility, LogSw

-3.82

Polar Surface Area

96.792

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

-0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

L453-0296 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L453-0296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L453-0296?
Check Price and Availability of L453-0296, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L453-0296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L453-0296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L453-0296
  • 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 L453-0296 available by request