0052-0109 Screening compound: (E)-[4-(octadecyloxy)phenyl](phenyl)diazene

0052-0109 Screening compound: (E)-[4-(octadecyloxy)phenyl](phenyl)diazene
0052-0109 Screening compound: (E)-[4-(octadecyloxy)phenyl](phenyl)diazene alternative view

Chemical Structure Depiction of ChemDiv screening compound 0052-0109
(E)-[4-(octadecyloxy)phenyl](phenyl)diazene

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

0052-0109

Molecular Formula

C30H46N2O (C30 H46 N2 O)

Compound Name

(E)-[4-(octadecyloxy)phenyl](phenyl)diazene

IUPAC name

(E)-[4-(octadecyloxy)phenyl](phenyl)diazene

SMILES

CCCCCCCCCCCCCCCCCCOc(cc1)ccc1/N=N/c1ccccc1

InChI

InChI=1S/C30H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27-33-30-25-23-29(24-26-30)32-31-28-21-18-17-19-22-28/h17-19,21-26H,2-16,20,27H2,1H3

InChI Key

XTDQGGFIEHPPAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00804633

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.71

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

20.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

12.607

Distribution Coefficient, logD

12.607

Water Solubility, LogSw

-5.99

Polar Surface Area

29.343

Acid Dissociation Constant (pKa)

27.86

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

0052-0109 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Frequent Hitters Library (7624 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0052-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0052-0109?
Check Price and Availability of 0052-0109, 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 0052-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0052-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0052-0109
  • 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 0052-0109 available by request