L472-0020 Screening compound: N-(2-methyl-1-{3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}propyl)benzenesulfonamide

L472-0020 Screening compound: N-(2-methyl-1-{3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}propyl)benzenesulfonamide
L472-0020 Screening compound: N-(2-methyl-1-{3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}propyl)benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L472-0020
N-(2-methyl-1-{3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}propyl)benzenesulfonamide

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

L472-0020

Molecular Formula

C22H22N4O3S2 (C22 H22 N4 O3 S2)

Compound Name

N-(2-methyl-1-{3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}propyl)benzenesulfonamide

IUPAC name

N-(2-methyl-1-{3-[4-(2-methyl-13-thiazol-4-yl)phenyl]-124-oxadiazol-5-yl}propyl)benzenesulfonamide

SMILES

CC(C)C(c1nc(-c(cc2)ccc2-c2csc(C)n2)no1)NS(c1ccccc1)(=O)=O

InChI

InChI=1S/C22H22N4O3S2/c1-14(2)20(26-31(27,28)18-7-5-4-6-8-18)22-24-21(25-29-22)17-11-9-16(10-12-17)19-13-30-15(3)23-19/h4-14,20,26H,1-3H3/t20-/m0/s1

InChI Key

UJWISBWBBBCIBB-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27454896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.823

Distribution Coefficient, logD

5.743

Water Solubility, LogSw

-5.71

Polar Surface Area

82.780

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

0.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

L472-0020 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L472-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L472-0020?
Check Price and Availability of L472-0020, 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 L472-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L472-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L472-0020
  • 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 L472-0020 available by request