3286-0443 Screening compound: N-{4-[(1E)-1-[(4-nitrobenzenesulfonamido)imino]ethyl]phenyl}furan-2-carboxamide

3286-0443 Screening compound: N-{4-[(1E)-1-[(4-nitrobenzenesulfonamido)imino]ethyl]phenyl}furan-2-carboxamide
3286-0443 Screening compound: N-{4-[(1E)-1-[(4-nitrobenzenesulfonamido)imino]ethyl]phenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3286-0443
N-{4-[(1E)-1-[(4-nitrobenzenesulfonamido)imino]ethyl]phenyl}furan-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

3286-0443

Molecular Formula

C19H16N4O6S (C19 H16 N4 O6 S)

Compound Name

N-{4-[(1E)-1-[(4-nitrobenzenesulfonamido)imino]ethyl]phenyl}furan-2-carboxamide

IUPAC name

N-{4-[(1E)-1-[(4-nitrobenzenesulfonamido)imino]ethyl]phenyl}furan-2-carboxamide

SMILES

C/C(/c(cc1)ccc1NC(c1ccco1)=O)=N\NS(c(cc1)ccc1[N+]([O-])=O)(=O)=O

InChI

InChI=1S/C19H16N4O6S/c1-13(21-22-30(27,28)17-10-8-16(9-11-17)23(25)26)14-4-6-15(7-5-14)20-19(24)18-3-2-12-29-18/h2-12,22H,1H3,(H,20,24)/b21-13+

InChI Key

VBSRNSRTPOKNTP-FYJGNVAPSA-N

MDL Number (MFCD)

MFCD00584353

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.43

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.151

Distribution Coefficient, logD

-0.232

Water Solubility, LogSw

-3.66

Polar Surface Area

115.167

Acid Dissociation Constant (pKa)

4.02

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

3286-0443 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3286-0443 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3286-0443?
Check Price and Availability of 3286-0443, 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 3286-0443 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3286-0443
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3286-0443
  • 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 3286-0443 available by request