4581-2637 Screening compound: 5-(adamantan-1-yl)-3-(4-bromophenyl)-1,2,4-oxadiazole

4581-2637 Screening compound: 5-(adamantan-1-yl)-3-(4-bromophenyl)-1,2,4-oxadiazole
4581-2637 Screening compound: 5-(adamantan-1-yl)-3-(4-bromophenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4581-2637
5-(adamantan-1-yl)-3-(4-bromophenyl)-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

4581-2637

Molecular Formula

C18H19BrN2O (C18 H19 BrN2 O)

Compound Name

5-(adamantan-1-yl)-3-(4-bromophenyl)-1,2,4-oxadiazole

IUPAC name

5-(adamantan-1-yl)-3-(4-bromophenyl)-124-oxadiazole

SMILES

Brc(cc1)ccc1-c1noc(C2(CC(C3)C4)CC4CC3C2)n1

InChI

InChI=1S/C18H19BrN2O/c19-15-3-1-14(2-4-15)16-20-17(22-21-16)18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2

InChI Key

CJRGWUABMOPMBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01832048

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.27

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

6.570

Distribution Coefficient, logD

6.570

Water Solubility, LogSw

-6.41

Polar Surface Area

31.678

Acid Dissociation Constant (pKa)

25.02

Base Dissociation Constant (pKb)

-2.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

4581-2637 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4581-2637 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4581-2637?
Check Price and Availability of 4581-2637, 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 4581-2637 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4581-2637
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4581-2637
  • 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 4581-2637 available by request