F800-0227 Screening compound: N-[(4-fluorophenyl)methyl]-6-(4-methylbenzenesulfonyl)pyridine-3-carboxamide

F800-0227 Screening compound: N-[(4-fluorophenyl)methyl]-6-(4-methylbenzenesulfonyl)pyridine-3-carboxamide
F800-0227 Screening compound: N-[(4-fluorophenyl)methyl]-6-(4-methylbenzenesulfonyl)pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F800-0227
N-[(4-fluorophenyl)methyl]-6-(4-methylbenzenesulfonyl)pyridine-3-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

F800-0227

Molecular Formula

C20H17FN2O3S (C20 H17 FN2 O3 S)

Compound Name

N-[(4-fluorophenyl)methyl]-6-(4-methylbenzenesulfonyl)pyridine-3-carboxamide

IUPAC name

N-[(4-fluorophenyl)methyl]-6-(4-methylbenzenesulfonyl)pyridine-3-carboxamide

SMILES

Cc(cc1)ccc1S(c(cc1)ncc1C(NCc(cc1)ccc1F)=O)(=O)=O

InChI

InChI=1S/C20H17FN2O3S/c1-14-2-9-18(10-3-14)27(25,26)19-11-6-16(13-22-19)20(24)23-12-15-4-7-17(21)8-5-15/h2-11,13H,12H2,1H3,(H,23,24)

InChI Key

CRCCZDSUZUYQTM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27191689

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.43

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

3.494

Distribution Coefficient, logD

3.493

Water Solubility, LogSw

-3.65

Polar Surface Area

63.065

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

-3.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

F800-0227 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F800-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F800-0227?
Check Price and Availability of F800-0227, 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 F800-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F800-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F800-0227
  • 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 F800-0227 available by request