4904-1041 Screening compound: 3-(4-bromophenyl)-5-(3-iodophenyl)-1,2,4-oxadiazole

4904-1041 Screening compound: 3-(4-bromophenyl)-5-(3-iodophenyl)-1,2,4-oxadiazole
4904-1041 Screening compound: 3-(4-bromophenyl)-5-(3-iodophenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4904-1041
3-(4-bromophenyl)-5-(3-iodophenyl)-1,2,4-oxadiazole

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

4904-1041

Molecular Formula

C14H8BrIN2O (C14 H8 BrIN2 O)

Compound Name

3-(4-bromophenyl)-5-(3-iodophenyl)-1,2,4-oxadiazole

IUPAC name

3-(4-bromophenyl)-5-(3-iodophenyl)-124-oxadiazole

SMILES

Brc(cc1)ccc1-c1noc(-c2cccc(I)c2)n1

InChI

InChI=1S/C14H8BrIN2O/c15-11-6-4-9(5-7-11)13-17-14(19-18-13)10-2-1-3-12(16)8-10/h1-8H

InChI Key

RAWVUDJJFPVYQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02945446

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.04

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.077

Distribution Coefficient, logD

6.077

Water Solubility, LogSw

-6.34

Polar Surface Area

31.644

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-5.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4904-1041 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Autophagy-Targeted Library (4564 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4904-1041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4904-1041?
Check Price and Availability of 4904-1041, 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 4904-1041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4904-1041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4904-1041
  • 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 4904-1041 available by request