1486-0337 Screening compound: ethyl 5-{[1,1'-biphenyl]-4-carbonyloxy}-4-bromo-2-formyl-7-methyl-1-benzofuran-3-carboxylate

1486-0337 Screening compound: ethyl 5-{[1,1'-biphenyl]-4-carbonyloxy}-4-bromo-2-formyl-7-methyl-1-benzofuran-3-carboxylate
1486-0337 Screening compound: ethyl 5-{[1,1'-biphenyl]-4-carbonyloxy}-4-bromo-2-formyl-7-methyl-1-benzofuran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1486-0337
ethyl 5-{[1,1'-biphenyl]-4-carbonyloxy}-4-bromo-2-formyl-7-methyl-1-benzofuran-3-carboxylate

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

1486-0337

Molecular Formula

C26H19BrO6 (C26 H19 BrO6)

Compound Name

ethyl 5-{[1,1'-biphenyl]-4-carbonyloxy}-4-bromo-2-formyl-7-methyl-1-benzofuran-3-carboxylate

IUPAC name

ethyl 5-{[11'-biphenyl]-4-carbonyloxy}-4-bromo-2-formyl-7-methyl-1-benzofuran-3-carboxylate

SMILES

CCOC(c1c(C=O)oc(c(C)c2)c1c(Br)c2OC(c(cc1)ccc1-c1ccccc1)=O)=O

InChI

InChI=1S/C26H19BrO6/c1-3-31-26(30)21-20(14-28)32-24-15(2)13-19(23(27)22(21)24)33-25(29)18-11-9-17(10-12-18)16-7-5-4-6-8-16/h4-14H,3H2,1-2H3

InChI Key

APVMBTVGKYVZRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01838839

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.140

Distribution Coefficient, logD

6.140

Water Solubility, LogSw

-5.92

Polar Surface Area

63.274

Acid Dissociation Constant (pKa)

26.89

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

1486-0337 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

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

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 1486-0337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1486-0337?
Check Price and Availability of 1486-0337, 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 1486-0337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1486-0337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1486-0337
  • 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 1486-0337 available by request