J057-0662 Screening compound: 4-{5-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-methoxybenzenesulfonyl}morpholine

J057-0662 Screening compound: 4-{5-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-methoxybenzenesulfonyl}morpholine
J057-0662 Screening compound: 4-{5-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-methoxybenzenesulfonyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound J057-0662
4-{5-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-methoxybenzenesulfonyl}morpholine

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

J057-0662

Molecular Formula

C21H23N3O7S (C21 H23 N3 O7 S)

Compound Name

4-{5-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-methoxybenzenesulfonyl}morpholine

IUPAC name

4-{5-[5-(34-dimethoxyphenyl)-134-oxadiazol-2-yl]-2-methoxybenzenesulfonyl}morpholine

SMILES

COc(ccc(-c1nnc(-c(cc2)cc(S(N3CCOCC3)(=O)=O)c2OC)o1)c1)c1OC

InChI

InChI=1S/C21H23N3O7S/c1-27-16-6-4-14(12-18(16)29-3)20-22-23-21(31-20)15-5-7-17(28-2)19(13-15)32(25,26)24-8-10-30-11-9-24/h4-7,12-13H,8-11H2,1-3H3

InChI Key

QTGHREWBBHMHSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.5

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.015

Distribution Coefficient, logD

2.015

Water Solubility, LogSw

-2.51

Polar Surface Area

92.993

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

J057-0662 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with J057-0662 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J057-0662?
Check Price and Availability of J057-0662, 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 J057-0662 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J057-0662
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J057-0662
  • 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 J057-0662 available by request