5218-1380 Screening compound: 1-ethynyl-4-[2-(4-ethynylphenyl)ethynyl]benzene

5218-1380 Screening compound: 1-ethynyl-4-[2-(4-ethynylphenyl)ethynyl]benzene
5218-1380 Screening compound: 1-ethynyl-4-[2-(4-ethynylphenyl)ethynyl]benzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 5218-1380
1-ethynyl-4-[2-(4-ethynylphenyl)ethynyl]benzene

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

5218-1380

Molecular Formula

C18H10 (C18 H10)

Compound Name

1-ethynyl-4-[2-(4-ethynylphenyl)ethynyl]benzene

IUPAC name

1-ethynyl-4-[2-(4-ethynylphenyl)ethynyl]benzene

SMILES

C#Cc(cc1)ccc1C#Cc(cc1)ccc1C#C

InChI

InChI=1S/C18H10/c1-3-15-5-9-17(10-6-15)13-14-18-11-7-16(4-2)8-12-18/h1-2,5-12H

InChI Key

TWIVNHSGJOJLJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02269531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

226.28

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

n/a

Partition Coefficient, logP

5.037

Distribution Coefficient, logD

5.037

Water Solubility, LogSw

-5.11

Polar Surface Area

0.000

Acid Dissociation Constant (pKa)

24.96

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

5218-1380 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5218-1380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5218-1380?
Check Price and Availability of 5218-1380, 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 5218-1380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5218-1380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5218-1380
  • 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 5218-1380 available by request