1683-6216 Screening compound: N-[(furan-2-yl)methyl]-4-methylbenzamide

1683-6216 Screening compound: N-[(furan-2-yl)methyl]-4-methylbenzamide
1683-6216 Screening compound: N-[(furan-2-yl)methyl]-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-6216
N-[(furan-2-yl)methyl]-4-methylbenzamide

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

1683-6216

Molecular Formula

C13H13NO2 (C13 H13 NO2)

Compound Name

N-[(furan-2-yl)methyl]-4-methylbenzamide

IUPAC name

N-[(furan-2-yl)methyl]-4-methylbenzamide

SMILES

Cc(cc1)ccc1C(NCc1ccco1)=O

InChI

InChI=1S/C13H13NO2/c1-10-4-6-11(7-5-10)13(15)14-9-12-3-2-8-16-12/h2-8H,9H2,1H3,(H,14,15)

InChI Key

BJNKXNBPVDNGMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00159517

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

215.25

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.861

Distribution Coefficient, logD

2.861

Water Solubility, LogSw

-3.16

Polar Surface Area

32.401

Acid Dissociation Constant (pKa)

11.42

Base Dissociation Constant (pKb)

-4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

1683-6216 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1683-6216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-6216?
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What is the minimum amount of 1683-6216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-6216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-6216
  • 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 1683-6216 available by request