G229-0643 Screening compound: 1-(4-chlorophenyl)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyrrolidinone

G229-0643 Screening compound: 1-(4-chlorophenyl)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyrrolidinone
G229-0643 Screening compound: 1-(4-chlorophenyl)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyrrolidinone alternative view

Chemical Structure Depiction of ChemDiv screening compound G229-0643
1-(4-chlorophenyl)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyrrolidinone

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

G229-0643

Molecular Formula

C14H14ClN3O2 (C14 H14 ClN3 O2)

Compound Name

1-(4-chlorophenyl)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyrrolidinone

IUPAC name

1-(4-chlorophenyl)-4-(3-ethyl-124-oxadiazol-5-yl)pyrrolidin-2-one

SMILES

CCc1noc(C(CC2=O)CN2c(cc2)ccc2Cl)n1

InChI

InChI=1S/C14H14ClN3O2/c1-2-12-16-14(20-17-12)9-7-13(19)18(8-9)11-5-3-10(15)4-6-11/h3-6,9H,2,7-8H2,1H3/t9-/m1/s1

InChI Key

UYEGHWNJUSHLQY-SECBINFHSA-N

MDL Number (MFCD)

MFCD14222872

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.74

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.982

Distribution Coefficient, logD

2.982

Water Solubility, LogSw

-3.25

Polar Surface Area

49.656

Acid Dissociation Constant (pKa)

11.87

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.71

G229-0643 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 G229-0643 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G229-0643?
Check Price and Availability of G229-0643, 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 G229-0643 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G229-0643
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G229-0643
  • 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 G229-0643 available by request