8017-8445 Screening compound: 3-ethoxy-4-fluoro-N~1~-(4-pyridylmethyl)-1-benzenesulfonamide

8017-8445 Screening compound: 3-ethoxy-4-fluoro-N~1~-(4-pyridylmethyl)-1-benzenesulfonamide
8017-8445 Screening compound: 3-ethoxy-4-fluoro-N~1~-(4-pyridylmethyl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-8445
3-ethoxy-4-fluoro-N~1~-(4-pyridylmethyl)-1-benzenesulfonamide

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

8017-8445

Molecular Formula

C14H15FN2O3S (C14 H15 FN2 O3 S)

Compound Name

3-ethoxy-4-fluoro-N~1~-(4-pyridylmethyl)-1-benzenesulfonamide

IUPAC name

3-ethoxy-4-fluoro-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

SMILES

CCOc(cc(cc1)S(NCc2ccncc2)(=O)=O)c1F

InChI

InChI=1S/C14H15FN2O3S/c1-2-20-14-9-12(3-4-13(14)15)21(18,19)17-10-11-5-7-16-8-6-11/h3-9,17H,2,10H2,1H3

InChI Key

HUFSJAPNIJDJBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06618645

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.917

Distribution Coefficient, logD

1.905

Water Solubility, LogSw

-2.51

Polar Surface Area

58.635

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.43

8017-8445 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS Targets (44014 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Receptors Annotated Library (5376 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8017-8445 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-8445?
Check Price and Availability of 8017-8445, 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 8017-8445 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-8445
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-8445
  • 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 8017-8445 available by request