G229-0186 Screening compound: 1-(3-chloro-4-methoxyphenyl)-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one

G229-0186 Screening compound: 1-(3-chloro-4-methoxyphenyl)-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one
G229-0186 Screening compound: 1-(3-chloro-4-methoxyphenyl)-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G229-0186
1-(3-chloro-4-methoxyphenyl)-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one

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

G229-0186

Molecular Formula

C18H15ClN4O3 (C18 H15 ClN4 O3)

Compound Name

1-(3-chloro-4-methoxyphenyl)-4-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one

IUPAC name

1-(3-chloro-4-methoxyphenyl)-4-[3-(pyridin-2-yl)-124-oxadiazol-5-yl]pyrrolidin-2-one

SMILES

COc(ccc(N(CC(C1)c2nc(-c3ncccc3)no2)C1=O)c1)c1Cl

InChI

InChI=1S/C18H15ClN4O3/c1-25-15-6-5-12(9-13(15)19)23-10-11(8-16(23)24)18-21-17(22-26-18)14-4-2-3-7-20-14/h2-7,9,11H,8,10H2,1H3/t11-/m1/s1

InChI Key

ZUIBGFDTLSQXHD-LLVKDONJSA-N

MDL Number (MFCD)

MFCD09248043

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.79

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.884

Distribution Coefficient, logD

2.884

Water Solubility, LogSw

-3.17

Polar Surface Area

65.072

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

2.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

G229-0186 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 G229-0186 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G229-0186?
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What is the minimum amount of G229-0186 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G229-0186
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G229-0186
  • 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 G229-0186 available by request