8012-2760 Screening compound: 6,7-dimethyl-4-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroquinolin-2-one

8012-2760 Screening compound: 6,7-dimethyl-4-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroquinolin-2-one
8012-2760 Screening compound: 6,7-dimethyl-4-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-2760
6,7-dimethyl-4-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroquinolin-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

8012-2760

Molecular Formula

C18H16F3NO (C18 H16 F3 NO)

Compound Name

6,7-dimethyl-4-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroquinolin-2-one

IUPAC name

67-dimethyl-4-[3-(trifluoromethyl)phenyl]-1234-tetrahydroquinolin-2-one

SMILES

Cc(c(C)c1)cc(C(C2)c3cccc(C(F)(F)F)c3)c1NC2=O

InChI

InChI=1S/C18H16F3NO/c1-10-6-15-14(9-17(23)22-16(15)7-11(10)2)12-4-3-5-13(8-12)18(19,20)21/h3-8,14H,9H2,1-2H3,(H,22,23)/t14-/m0/s1

InChI Key

ROWDPLKMJQGPHL-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD02627335

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.33

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.596

Distribution Coefficient, logD

4.596

Water Solubility, LogSw

-4.43

Polar Surface Area

24.788

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

8012-2760 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8012-2760 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-2760?
Check Price and Availability of 8012-2760, 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 8012-2760 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-2760
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-2760
  • 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 8012-2760 available by request