3937-0030 Screening compound: N-(5-chloro-2-methoxyphenyl)-5-nitrofuran-2-carboxamide

3937-0030 Screening compound: N-(5-chloro-2-methoxyphenyl)-5-nitrofuran-2-carboxamide
3937-0030 Screening compound: N-(5-chloro-2-methoxyphenyl)-5-nitrofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3937-0030
N-(5-chloro-2-methoxyphenyl)-5-nitrofuran-2-carboxamide

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

3937-0030

Molecular Formula

C12H9ClN2O5 (C12 H9 ClN2 O5)

Compound Name

N-(5-chloro-2-methoxyphenyl)-5-nitrofuran-2-carboxamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-5-nitrofuran-2-carboxamide

SMILES

COc(ccc(Cl)c1)c1NC(c1ccc([N+]([O-])=O)o1)=O

InChI

InChI=1S/C12H9ClN2O5/c1-19-9-3-2-7(13)6-8(9)14-12(16)10-4-5-11(20-10)15(17)18/h2-6H,1H3,(H,14,16)

InChI Key

ISYBKJVJWAHUCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01212535

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.67

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.687

Distribution Coefficient, logD

2.159

Water Solubility, LogSw

-3.61

Polar Surface Area

72.923

Acid Dissociation Constant (pKa)

7.03

Base Dissociation Constant (pKb)

-2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

3937-0030 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 3937-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3937-0030?
Check Price and Availability of 3937-0030, 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 3937-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3937-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3937-0030
  • 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 3937-0030 available by request