8009-1964 Screening compound: 5-bromo-2-cyclopropanecarbonyl-1-benzofuran-3-amine

8009-1964 Screening compound: 5-bromo-2-cyclopropanecarbonyl-1-benzofuran-3-amine
8009-1964 Screening compound: 5-bromo-2-cyclopropanecarbonyl-1-benzofuran-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-1964
5-bromo-2-cyclopropanecarbonyl-1-benzofuran-3-amine

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

8009-1964

Molecular Formula

C12H10BrNO2 (C12 H10 BrNO2)

Compound Name

5-bromo-2-cyclopropanecarbonyl-1-benzofuran-3-amine

IUPAC name

5-bromo-2-cyclopropanecarbonyl-1-benzofuran-3-amine

SMILES

Nc1c(C(C2CC2)=O)oc(cc2)c1cc2Br

InChI

InChI=1S/C12H10BrNO2/c13-7-3-4-9-8(5-7)10(14)12(16-9)11(15)6-1-2-6/h3-6H,1-2,14H2

InChI Key

ABXZJBMHIILAJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01461855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.12

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.404

Distribution Coefficient, logD

3.404

Water Solubility, LogSw

-3.59

Polar Surface Area

42.141

Acid Dissociation Constant (pKa)

18.17

Base Dissociation Constant (pKb)

3.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8009-1964 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Lipid Metabolism Library (9174 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Metabolic
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8009-1964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-1964?
Check Price and Availability of 8009-1964, 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 8009-1964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-1964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-1964
  • 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 8009-1964 available by request