R082-0001 Screening compound: 5-(2-nitrophenyl)furan-2-carbaldehyde

R082-0001 Screening compound: 5-(2-nitrophenyl)furan-2-carbaldehyde
R082-0001 Screening compound: 5-(2-nitrophenyl)furan-2-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound R082-0001
5-(2-nitrophenyl)furan-2-carbaldehyde

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

R082-0001

Molecular Formula

C11H7NO4 (C11 H7 NO4)

Compound Name

5-(2-nitrophenyl)furan-2-carbaldehyde

IUPAC name

5-(2-nitrophenyl)furan-2-carbaldehyde

SMILES

[O-][N+](c(cccc1)c1-c1ccc(C=O)o1)=O

InChI

InChI=1S/C11H7NO4/c13-7-8-5-6-11(16-8)9-3-1-2-4-10(9)12(14)15/h1-7H

InChI Key

QBYRUURYXPVDAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00216586

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.18

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.183

Distribution Coefficient, logD

2.183

Water Solubility, LogSw

-2.55

Polar Surface Area

55.048

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

R082-0001 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 R082-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R082-0001?
Check Price and Availability of R082-0001, 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 R082-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R082-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R082-0001
  • 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 R082-0001 available by request