2627-0058 Screening compound: 2-{[(2E)-4-(2-formylphenoxy)but-2-en-1-yl]oxy}benzaldehyde

2627-0058 Screening compound: 2-{[(2E)-4-(2-formylphenoxy)but-2-en-1-yl]oxy}benzaldehyde
2627-0058 Screening compound: 2-{[(2E)-4-(2-formylphenoxy)but-2-en-1-yl]oxy}benzaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 2627-0058
2-{[(2E)-4-(2-formylphenoxy)but-2-en-1-yl]oxy}benzaldehyde

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

2627-0058

Molecular Formula

C18H16O4 (C18 H16 O4)

Compound Name

2-{[(2E)-4-(2-formylphenoxy)but-2-en-1-yl]oxy}benzaldehyde

IUPAC name

2-{[(2E)-4-(2-formylphenoxy)but-2-en-1-yl]oxy}benzaldehyde

SMILES

O=Cc(cccc1)c1OC/C=C/COc1c(C=O)cccc1

InChI

InChI=1S/C18H16O4/c19-13-15-7-1-3-9-17(15)21-11-5-6-12-22-18-10-4-2-8-16(18)14-20/h1-10,13-14H,11-12H2

InChI Key

YDWFXNATFVVIKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02926731

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.240

Distribution Coefficient, logD

4.240

Water Solubility, LogSw

-4.46

Polar Surface Area

43.294

Acid Dissociation Constant (pKa)

32.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

2627-0058 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2627-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2627-0058?
Check Price and Availability of 2627-0058, 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 2627-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2627-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2627-0058
  • 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 2627-0058 available by request