G642-6580 Screening compound: 1-[2-(3-bromophenyl)-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one

G642-6580 Screening compound: 1-[2-(3-bromophenyl)-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one
G642-6580 Screening compound: 1-[2-(3-bromophenyl)-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-6580
1-[2-(3-bromophenyl)-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-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

G642-6580

Molecular Formula

C16H12BrN3O4 (C16 H12 BrN3 O4)

Compound Name

1-[2-(3-bromophenyl)-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl]ethan-1-one

IUPAC name

1-[2-(3-bromophenyl)-5-(3-nitrophenyl)-23-dihydro-134-oxadiazol-3-yl]ethan-1-one

SMILES

CC(N1N=C(c2cc([N+]([O-])=O)ccc2)OC1c1cccc(Br)c1)=O

InChI

InChI=1S/C16H12BrN3O4/c1-10(21)19-16(12-5-2-6-13(17)8-12)24-15(18-19)11-4-3-7-14(9-11)20(22)23/h2-9,16H,1H3/t16-/m0/s1

InChI Key

ZMZXQLHYLYSPCB-INIZCTEOSA-N

MDL Number (MFCD)

MFCD02046108

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.19

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.031

Distribution Coefficient, logD

4.031

Water Solubility, LogSw

-4.15

Polar Surface Area

68.633

Acid Dissociation Constant (pKa)

23.45

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

G642-6580 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G642-6580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-6580?
Check Price and Availability of G642-6580, 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 G642-6580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-6580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-6580
  • 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 G642-6580 available by request