8015-0997 Screening compound: 3-(aminomethyl)furan-2-carboxylic acid

8015-0997 Screening compound: 3-(aminomethyl)furan-2-carboxylic acid
8015-0997 Screening compound: 3-(aminomethyl)furan-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-0997
3-(aminomethyl)furan-2-carboxylic acid

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

8015-0997

Molecular Formula

C6H7NO3 (C6 H7 NO3)

Compound Name

3-(aminomethyl)furan-2-carboxylic acid

IUPAC name

3-(aminomethyl)furan-2-carboxylic acid

SMILES

NCc1c(C(O)=O)occ1

InChI

InChI=1S/C6H7NO3/c7-3-4-1-2-10-5(4)6(8)9/h1-2H,3,7H2,(H,8,9)

InChI Key

BJDBDPLJQFTEKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03855489

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

141.13

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

-0.788

Distribution Coefficient, logD

-0.788

Water Solubility, LogSw

-0.94

Polar Surface Area

59.118

Acid Dissociation Constant (pKa)

2.65

Base Dissociation Constant (pKb)

10.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8015-0997 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

GABA Library (7115 compounds)

Akt-Targeted Library (14764 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Eye
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • Kinases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8015-0997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-0997?
Check Price and Availability of 8015-0997, 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 8015-0997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-0997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-0997
  • 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 8015-0997 available by request