G229-0613 Screening compound: 1-(4-chlorophenyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one

G229-0613 Screening compound: 1-(4-chlorophenyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one
G229-0613 Screening compound: 1-(4-chlorophenyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G229-0613
1-(4-chlorophenyl)-4-(3-methyl-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

G229-0613

Molecular Formula

C13H12ClN3O2 (C13 H12 ClN3 O2)

Compound Name

1-(4-chlorophenyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one

IUPAC name

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

SMILES

Cc1noc(C(CC2=O)CN2c(cc2)ccc2Cl)n1

InChI

InChI=1S/C13H12ClN3O2/c1-8-15-13(19-16-8)9-6-12(18)17(7-9)11-4-2-10(14)3-5-11/h2-5,9H,6-7H2,1H3/t9-/m1/s1

InChI Key

HLMCPWPERWFXMS-SECBINFHSA-N

MDL Number (MFCD)

MFCD14222871

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.71

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.313

Distribution Coefficient, logD

2.313

Water Solubility, LogSw

-2.97

Polar Surface Area

48.278

Acid Dissociation Constant (pKa)

11.87

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

G229-0613 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with G229-0613 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G229-0613?
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What is the minimum amount of G229-0613 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G229-0613
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G229-0613
  • 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 G229-0613 available by request