K786-3735 Screening compound: N-allyl-6-(morpholinosulfonyl)-2-(2-pyridyl)-4-quinolinecarboxamide

K786-3735 Screening compound: N-allyl-6-(morpholinosulfonyl)-2-(2-pyridyl)-4-quinolinecarboxamide
K786-3735 Screening compound: N-allyl-6-(morpholinosulfonyl)-2-(2-pyridyl)-4-quinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-3735
N-allyl-6-(morpholinosulfonyl)-2-(2-pyridyl)-4-quinolinecarboxamide

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

K786-3735

Molecular Formula

C22H22N4O4S (C22 H22 N4 O4 S)

Compound Name

N-allyl-6-(morpholinosulfonyl)-2-(2-pyridyl)-4-quinolinecarboxamide

IUPAC name

6-(morpholine-4-sulfonyl)-N-(prop-2-en-1-yl)-2-(pyridin-2-yl)quinoline-4-carboxamide

SMILES

C=CCNC(c1c(cc(cc2)S(N3CCOCC3)(=O)=O)c2nc(-c2ncccc2)c1)=O

InChI

InChI=1S/C22H22N4O4S/c1-2-8-24-22(27)18-15-21(20-5-3-4-9-23-20)25-19-7-6-16(14-17(18)19)31(28,29)26-10-12-30-13-11-26/h2-7,9,14-15H,1,8,10-13H2,(H,24,27)

InChI Key

CAUOYNXLSCQVIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15100909

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.452

Distribution Coefficient, logD

2.452

Water Solubility, LogSw

-3.06

Polar Surface Area

81.491

Acid Dissociation Constant (pKa)

13.97

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.73

K786-3735 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

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

Immunological Library (6760 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Immune system

References: we are preparing a list of scientific research reports with K786-3735 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-3735?
Check Price and Availability of K786-3735, 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 K786-3735 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-3735
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-3735
  • 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 K786-3735 available by request