K784-1411 Screening compound: 2-fluoro-5-(morpholine-4-sulfonyl)benzonitrile

K784-1411 Screening compound: 2-fluoro-5-(morpholine-4-sulfonyl)benzonitrile
K784-1411 Screening compound: 2-fluoro-5-(morpholine-4-sulfonyl)benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1411
2-fluoro-5-(morpholine-4-sulfonyl)benzonitrile

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

K784-1411

Molecular Formula

C11H11FN2O3S (C11 H11 FN2 O3 S)

Compound Name

2-fluoro-5-(morpholine-4-sulfonyl)benzonitrile

IUPAC name

2-fluoro-5-(morpholine-4-sulfonyl)benzonitrile

SMILES

N#Cc(cc(cc1)S(N2CCOCC2)(=O)=O)c1F

InChI

InChI=1S/C11H11FN2O3S/c12-11-2-1-10(7-9(11)8-13)18(15,16)14-3-5-17-6-4-14/h1-2,7H,3-6H2

InChI Key

SWHQHJPIWNZWIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03830504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.28

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.201

Distribution Coefficient, logD

1.201

Water Solubility, LogSw

-2.50

Polar Surface Area

56.914

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-7.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

K784-1411 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with K784-1411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-1411?
Check Price and Availability of K784-1411, 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 K784-1411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1411
  • 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 K784-1411 available by request