G851-1062 Screening compound: 5-[(4-chlorophenoxy)methyl]-3-(5-methylthiophen-2-yl)-1,2,4-oxadiazole

G851-1062 Screening compound: 5-[(4-chlorophenoxy)methyl]-3-(5-methylthiophen-2-yl)-1,2,4-oxadiazole
G851-1062 Screening compound: 5-[(4-chlorophenoxy)methyl]-3-(5-methylthiophen-2-yl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G851-1062
5-[(4-chlorophenoxy)methyl]-3-(5-methylthiophen-2-yl)-1,2,4-oxadiazole

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

G851-1062

Molecular Formula

C14H11ClN2O2S (C14 H11 ClN2 O2 S)

Compound Name

5-[(4-chlorophenoxy)methyl]-3-(5-methylthiophen-2-yl)-1,2,4-oxadiazole

IUPAC name

5-[(4-chlorophenoxy)methyl]-3-(5-methylthiophen-2-yl)-124-oxadiazole

SMILES

Cc1ccc(-c2noc(COc(cc3)ccc3Cl)n2)s1

InChI

InChI=1S/C14H11ClN2O2S/c1-9-2-7-12(20-9)14-16-13(19-17-14)8-18-11-5-3-10(15)4-6-11/h2-7H,8H2,1H3

InChI Key

ROIKTDOQADWQOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15040663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.77

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.846

Distribution Coefficient, logD

4.846

Water Solubility, LogSw

-4.83

Polar Surface Area

39.827

Acid Dissociation Constant (pKa)

30.98

Base Dissociation Constant (pKb)

-4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

G851-1062 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G851-1062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G851-1062?
Check Price and Availability of G851-1062, 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 G851-1062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G851-1062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G851-1062
  • 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 G851-1062 available by request