G349-1231 Screening compound: 3-(4-methoxyphenyl)-N-[2-(thiophen-3-yl)ethyl]-1,2,4-oxadiazol-5-amine

G349-1231 Screening compound: 3-(4-methoxyphenyl)-N-[2-(thiophen-3-yl)ethyl]-1,2,4-oxadiazol-5-amine
G349-1231 Screening compound: 3-(4-methoxyphenyl)-N-[2-(thiophen-3-yl)ethyl]-1,2,4-oxadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G349-1231
3-(4-methoxyphenyl)-N-[2-(thiophen-3-yl)ethyl]-1,2,4-oxadiazol-5-amine

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

G349-1231

Molecular Formula

C15H15N3O2S (C15 H15 N3 O2 S)

Compound Name

3-(4-methoxyphenyl)-N-[2-(thiophen-3-yl)ethyl]-1,2,4-oxadiazol-5-amine

IUPAC name

3-(4-methoxyphenyl)-N-[2-(thiophen-3-yl)ethyl]-124-oxadiazol-5-amine

SMILES

COc(cc1)ccc1-c1noc(NCCc2cscc2)n1

InChI

InChI=1S/C15H15N3O2S/c1-19-13-4-2-12(3-5-13)14-17-15(20-18-14)16-8-6-11-7-9-21-10-11/h2-5,7,9-10H,6,8H2,1H3,(H,16,17,18)

InChI Key

GKSZELCKZQNTAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15000398

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.410

Distribution Coefficient, logD

3.410

Water Solubility, LogSw

-3.68

Polar Surface Area

51.867

Acid Dissociation Constant (pKa)

18.89

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G349-1231 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 G349-1231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G349-1231?
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What is the minimum amount of G349-1231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G349-1231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G349-1231
  • 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 G349-1231 available by request