6526-0486 Screening compound: 1-(6-bromo-5-methoxy-2-methyl-1-benzofuran-3-carbonyl)-4-(2-methylphenyl)piperazine

6526-0486 Screening compound: 1-(6-bromo-5-methoxy-2-methyl-1-benzofuran-3-carbonyl)-4-(2-methylphenyl)piperazine
6526-0486 Screening compound: 1-(6-bromo-5-methoxy-2-methyl-1-benzofuran-3-carbonyl)-4-(2-methylphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6526-0486
1-(6-bromo-5-methoxy-2-methyl-1-benzofuran-3-carbonyl)-4-(2-methylphenyl)piperazine

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

6526-0486

Molecular Formula

C22H23BrN2O3 (C22 H23 BrN2 O3)

Compound Name

1-(6-bromo-5-methoxy-2-methyl-1-benzofuran-3-carbonyl)-4-(2-methylphenyl)piperazine

IUPAC name

1-(6-bromo-5-methoxy-2-methyl-1-benzofuran-3-carbonyl)-4-(2-methylphenyl)piperazine

SMILES

Cc(oc1c2)c(C(N(CC3)CCN3c3c(C)cccc3)=O)c1cc(OC)c2Br

InChI

InChI=1S/C22H23BrN2O3/c1-14-6-4-5-7-18(14)24-8-10-25(11-9-24)22(26)21-15(2)28-19-13-17(23)20(27-3)12-16(19)21/h4-7,12-13H,8-11H2,1-3H3

InChI Key

CZIDGNROYZDNMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01578628

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.889

Distribution Coefficient, logD

4.889

Water Solubility, LogSw

-4.84

Polar Surface Area

35.424

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

6526-0486 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6526-0486 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6526-0486?
Check Price and Availability of 6526-0486, 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 6526-0486 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6526-0486
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6526-0486
  • 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 6526-0486 available by request