J062-0211 Screening compound: 4-chloro-N-[5-oxo-2-(4-propoxyphenyl)-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]benzamide

J062-0211 Screening compound: 4-chloro-N-[5-oxo-2-(4-propoxyphenyl)-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]benzamide
J062-0211 Screening compound: 4-chloro-N-[5-oxo-2-(4-propoxyphenyl)-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J062-0211
4-chloro-N-[5-oxo-2-(4-propoxyphenyl)-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-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

J062-0211

Molecular Formula

C21H17ClN4O4 (C21 H17 ClN4 O4)

Compound Name

4-chloro-N-[5-oxo-2-(4-propoxyphenyl)-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]benzamide

IUPAC name

4-chloro-N-[5-oxo-2-(4-propoxyphenyl)-5H-[134]oxadiazolo[32-a]pyrimidin-6-yl]benzamide

SMILES

CCCOc(cc1)ccc1C(OC1=NC=C2NC(c(cc3)ccc3Cl)=O)=NN1C2=O

InChI

InChI=1S/C21H17ClN4O4/c1-2-11-29-16-9-5-14(6-10-16)19-25-26-20(28)17(12-23-21(26)30-19)24-18(27)13-3-7-15(22)8-4-13/h3-10,12H,2,11H2,1H3,(H,24,27)

InChI Key

XJVRBIVACWFVRB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.84

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.157

Distribution Coefficient, logD

0.743

Water Solubility, LogSw

-3.86

Polar Surface Area

77.457

Acid Dissociation Constant (pKa)

4.99

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

J062-0211 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with J062-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J062-0211?
Check Price and Availability of J062-0211, 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 J062-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J062-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J062-0211
  • 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 J062-0211 available by request