Y031-9341 Screening compound: N-(4-methylphenyl)-5-nitro-2-furamide

Y031-9341 Screening compound: N-(4-methylphenyl)-5-nitro-2-furamide
Y031-9341 Screening compound: N-(4-methylphenyl)-5-nitro-2-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-9341
N-(4-methylphenyl)-5-nitro-2-furamide

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

Y031-9341

Molecular Formula

C12H10N2O4 (C12 H10 N2 O4)

Compound Name

N-(4-methylphenyl)-5-nitro-2-furamide

IUPAC name

N-(4-methylphenyl)-5-nitrofuran-2-carboxamide

SMILES

Cc(cc1)ccc1NC(c1ccc([N+]([O-])=O)o1)=O

InChI

InChI=1S/C12H10N2O4/c1-8-2-4-9(5-3-8)13-12(15)10-6-7-11(18-10)14(16)17/h2-7H,1H3,(H,13,15)

InChI Key

UMBRMDXTPOADQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00451498

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.22

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.659

Distribution Coefficient, logD

2.658

Water Solubility, LogSw

-3.18

Polar Surface Area

65.990

Acid Dissociation Constant (pKa)

10.23

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.33

Y031-9341 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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 Y031-9341 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-9341?
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What is the minimum amount of Y031-9341 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-9341
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-9341
  • 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 Y031-9341 available by request