Y031-7650 Screening compound: 5-nitro-N-octyl-2-furamide

Y031-7650 Screening compound: 5-nitro-N-octyl-2-furamide
Y031-7650 Screening compound: 5-nitro-N-octyl-2-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7650
5-nitro-N-octyl-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

Y031-7650

Molecular Formula

C13H20N2O4 (C13 H20 N2 O4)

Compound Name

5-nitro-N-octyl-2-furamide

IUPAC name

5-nitro-N-octylfuran-2-carboxamide

SMILES

CCCCCCCCNC(c1ccc([N+]([O-])=O)o1)=O

InChI

InChI=1S/C13H20N2O4/c1-2-3-4-5-6-7-10-14-13(16)11-8-9-12(19-11)15(17)18/h8-9H,2-7,10H2,1H3,(H,14,16)

InChI Key

SHGFUFKFELGKAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00437392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.515

Distribution Coefficient, logD

3.515

Water Solubility, LogSw

-3.49

Polar Surface Area

67.425

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

-2.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.54

Y031-7650 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y031-7650 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7650?
Check Price and Availability of Y031-7650, 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 Y031-7650 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7650
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7650
  • 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 Y031-7650 available by request