F360-1002 Screening compound: 6-methoxy-4-{[3-(trifluoromethyl)phenyl]amino}quinoline-3-carbonitrile

F360-1002 Screening compound: 6-methoxy-4-{[3-(trifluoromethyl)phenyl]amino}quinoline-3-carbonitrile
F360-1002 Screening compound: 6-methoxy-4-{[3-(trifluoromethyl)phenyl]amino}quinoline-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound F360-1002
6-methoxy-4-{[3-(trifluoromethyl)phenyl]amino}quinoline-3-carbonitrile

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

F360-1002

Molecular Formula

C18H12F3N3O (C18 H12 F3 N3 O)

Compound Name

6-methoxy-4-{[3-(trifluoromethyl)phenyl]amino}quinoline-3-carbonitrile

IUPAC name

6-methoxy-4-{[3-(trifluoromethyl)phenyl]amino}quinoline-3-carbonitrile

SMILES

COc(cc12)ccc2ncc(C#N)c1Nc1cccc(C(F)(F)F)c1

InChI

InChI=1S/C18H12F3N3O/c1-25-14-5-6-16-15(8-14)17(11(9-22)10-23-16)24-13-4-2-3-12(7-13)18(19,20)21/h2-8,10H,1H3,(H,23,24)

InChI Key

SOAOVPWSJMVSOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27119048

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

343.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.535

Distribution Coefficient, logD

4.533

Water Solubility, LogSw

-4.43

Polar Surface Area

41.208

Acid Dissociation Constant (pKa)

15.16

Base Dissociation Constant (pKb)

4.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

F360-1002 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F360-1002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F360-1002?
Check Price and Availability of F360-1002, 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 F360-1002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F360-1002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F360-1002
  • 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 F360-1002 available by request