8002-5855 Screening compound: 2-methyl-4,6-bis[4-(octyloxy)phenyl]pyridine

8002-5855 Screening compound: 2-methyl-4,6-bis[4-(octyloxy)phenyl]pyridine
8002-5855 Screening compound: 2-methyl-4,6-bis[4-(octyloxy)phenyl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-5855
2-methyl-4,6-bis[4-(octyloxy)phenyl]pyridine

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

8002-5855

Molecular Formula

C34H47NO2 (C34 H47 NO2)

Compound Name

2-methyl-4,6-bis[4-(octyloxy)phenyl]pyridine

IUPAC name

2-methyl-46-bis[4-(octyloxy)phenyl]pyridine

SMILES

CCCCCCCCOc(cc1)ccc1-c1cc(-c(cc2)ccc2OCCCCCCCC)nc(C)c1

InChI

InChI=1S/C34H47NO2/c1-4-6-8-10-12-14-24-36-32-20-16-29(17-21-32)31-26-28(3)35-34(27-31)30-18-22-33(23-19-30)37-25-15-13-11-9-7-5-2/h16-23,26-27H,4-15,24-25H2,1-3H3

InChI Key

BWYIKTQCXABEGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00626025

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.75

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

18.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

12.209

Distribution Coefficient, logD

12.142

Water Solubility, LogSw

-5.72

Polar Surface Area

22.953

Acid Dissociation Constant (pKa)

27.86

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8002-5855 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

MCL1 Targeted Library (12200 compounds)

PLpro Library (6343 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8002-5855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-5855?
Check Price and Availability of 8002-5855, 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 8002-5855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-5855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-5855
  • 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 8002-5855 available by request