G642-2739 Screening compound: 2-[3-acetyl-5-(2-cyclopropylquinolin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromophenyl acetate

G642-2739 Screening compound: 2-[3-acetyl-5-(2-cyclopropylquinolin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromophenyl acetate
G642-2739 Screening compound: 2-[3-acetyl-5-(2-cyclopropylquinolin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromophenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-2739
2-[3-acetyl-5-(2-cyclopropylquinolin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromophenyl acetate

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

G642-2739

Molecular Formula

C24H20BrN3O4 (C24 H20 BrN3 O4)

Compound Name

2-[3-acetyl-5-(2-cyclopropylquinolin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromophenyl acetate

IUPAC name

2-[3-acetyl-5-(2-cyclopropylquinolin-4-yl)-23-dihydro-134-oxadiazol-2-yl]-4-bromophenyl acetate

SMILES

CC(N1N=C(c2cc(C3CC3)nc3ccccc23)OC1c(cc(cc1)Br)c1OC(C)=O)=O

InChI

InChI=1S/C24H20BrN3O4/c1-13(29)28-24(19-11-16(25)9-10-22(19)31-14(2)30)32-23(27-28)18-12-21(15-7-8-15)26-20-6-4-3-5-17(18)20/h3-6,9-12,15,24H,7-8H2,1-2H3/t24-/m0/s1

InChI Key

SYSNOLNXXPNCGG-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD27148567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.939

Distribution Coefficient, logD

3.090

Water Solubility, LogSw

-4.90

Polar Surface Area

64.671

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

9.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

G642-2739 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G642-2739 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-2739?
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What is the minimum amount of G642-2739 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-2739
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-2739
  • 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 G642-2739 available by request