L294-0592 Screening compound: N-{4-[5-(4-cyano-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-4-methylbenzene-1-sulfonamide

L294-0592 Screening compound: N-{4-[5-(4-cyano-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-4-methylbenzene-1-sulfonamide
L294-0592 Screening compound: N-{4-[5-(4-cyano-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L294-0592
N-{4-[5-(4-cyano-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-4-methylbenzene-1-sulfonamide

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

L294-0592

Molecular Formula

C22H15FN4O3S (C22 H15 FN4 O3 S)

Compound Name

N-{4-[5-(4-cyano-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-4-methylbenzene-1-sulfonamide

IUPAC name

N-{4-[5-(4-cyano-2-fluorophenyl)-124-oxadiazol-3-yl]phenyl}-4-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(Nc(cc1)ccc1-c1noc(-c(ccc(C#N)c2)c2F)n1)(=O)=O

InChI

InChI=1S/C22H15FN4O3S/c1-14-2-9-18(10-3-14)31(28,29)27-17-7-5-16(6-8-17)21-25-22(30-26-21)19-11-4-15(13-24)12-20(19)23/h2-12,27H,1H3

InChI Key

VMSCETWRQDNCNV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15123139

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.320

Distribution Coefficient, logD

5.313

Water Solubility, LogSw

-5.50

Polar Surface Area

89.350

Acid Dissociation Constant (pKa)

9.18

Base Dissociation Constant (pKb)

-6.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

L294-0592 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with L294-0592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L294-0592?
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What is the minimum amount of L294-0592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L294-0592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L294-0592
  • 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 L294-0592 available by request