L948-3071 Screening compound: 4-{2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl}benzonitrile

L948-3071 Screening compound: 4-{2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl}benzonitrile
L948-3071 Screening compound: 4-{2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl}benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound L948-3071
4-{2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl}benzonitrile

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

L948-3071

Molecular Formula

C21H18N4O3 (C21 H18 N4 O3)

Compound Name

4-{2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carbonyl}benzonitrile

IUPAC name

4-{2-[3-(2-methoxyphenyl)-124-oxadiazol-5-yl]pyrrolidine-1-carbonyl}benzonitrile

SMILES

COc(cccc1)c1-c1noc(C(CCC2)N2C(c(cc2)ccc2C#N)=O)n1

InChI

InChI=1S/C21H18N4O3/c1-27-18-7-3-2-5-16(18)19-23-20(28-24-19)17-6-4-12-25(17)21(26)15-10-8-14(13-22)9-11-15/h2-3,5,7-11,17H,4,6,12H2,1H3/t17-/m0/s1

InChI Key

IMTHYFCLWZJWFA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27489150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.190

Distribution Coefficient, logD

3.190

Water Solubility, LogSw

-3.42

Polar Surface Area

73.039

Acid Dissociation Constant (pKa)

25.80

Base Dissociation Constant (pKb)

-6.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

L948-3071 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L948-3071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L948-3071?
Check Price and Availability of L948-3071, 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 L948-3071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L948-3071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L948-3071
  • 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 L948-3071 available by request