8279-0010 Screening compound: 7-chloro-4-phenyl-3-(pyridin-2-ylsulfanyl)-1,2-dihydroquinolin-2-one

8279-0010 Screening compound: 7-chloro-4-phenyl-3-(pyridin-2-ylsulfanyl)-1,2-dihydroquinolin-2-one
8279-0010 Screening compound: 7-chloro-4-phenyl-3-(pyridin-2-ylsulfanyl)-1,2-dihydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8279-0010
7-chloro-4-phenyl-3-(pyridin-2-ylsulfanyl)-1,2-dihydroquinolin-2-one

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

8279-0010

Molecular Formula

C20H13ClN2OS (C20 H13 ClN2 OS)

Compound Name

7-chloro-4-phenyl-3-(pyridin-2-ylsulfanyl)-1,2-dihydroquinolin-2-one

IUPAC name

7-chloro-4-phenyl-3-(pyridin-2-ylsulfanyl)-12-dihydroquinolin-2-one

SMILES

O=C1Nc(cc(cc2)Cl)c2C(c2ccccc2)=C1Sc1ncccc1

InChI

InChI=1S/C20H13ClN2OS/c21-14-9-10-15-16(12-14)23-20(24)19(25-17-8-4-5-11-22-17)18(15)13-6-2-1-3-7-13/h1-12H,(H,23,24)

InChI Key

KMVYOYQUGILHRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14713336

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.655

Distribution Coefficient, logD

4.654

Water Solubility, LogSw

-4.99

Polar Surface Area

32.982

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8279-0010 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8279-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8279-0010?
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What is the minimum amount of 8279-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8279-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8279-0010
  • 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 8279-0010 available by request