E535-1014 Screening compound: 5-[(3-chlorobenzenesulfinyl)methyl]-N-cyclopropylfuran-2-carboxamide

E535-1014 Screening compound: 5-[(3-chlorobenzenesulfinyl)methyl]-N-cyclopropylfuran-2-carboxamide
E535-1014 Screening compound: 5-[(3-chlorobenzenesulfinyl)methyl]-N-cyclopropylfuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E535-1014
5-[(3-chlorobenzenesulfinyl)methyl]-N-cyclopropylfuran-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

E535-1014

Molecular Formula

C15H14ClNO3S (C15 H14 ClNO3 S)

Compound Name

5-[(3-chlorobenzenesulfinyl)methyl]-N-cyclopropylfuran-2-carboxamide

IUPAC name

5-[(3-chlorobenzenesulfinyl)methyl]-N-cyclopropylfuran-2-carboxamide

SMILES

O=C(c1ccc(CS(c2cccc(Cl)c2)=O)o1)NC1CC1

InChI

InChI=1S/C15H16ClNO3S/c16-10-2-1-3-13(8-10)21(19)9-12-6-7-14(20-12)15(18)17-11-4-5-11/h1-3,6-8,11H,4-5,9,21H2,(H,17,18)

InChI Key

CPNVTCDCBSIQPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14896457

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.8

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.865

Distribution Coefficient, logD

2.865

Water Solubility, LogSw

-3.53

Polar Surface Area

47.690

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

-1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

E535-1014 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E535-1014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E535-1014?
Check Price and Availability of E535-1014, 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 E535-1014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E535-1014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E535-1014
  • 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 E535-1014 available by request