8013-2741 Screening compound: 4-(2-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroquinolin-2-one

8013-2741 Screening compound: 4-(2-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroquinolin-2-one
8013-2741 Screening compound: 4-(2-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-2741
4-(2-fluorophenyl)-6,7-dimethoxy-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

8013-2741

Molecular Formula

C17H16FNO3 (C17 H16 FNO3)

Compound Name

4-(2-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroquinolin-2-one

IUPAC name

4-(2-fluorophenyl)-67-dimethoxy-1234-tetrahydroquinolin-2-one

SMILES

COc(c(OC)c1)cc(C(C2)c(cccc3)c3F)c1NC2=O

InChI

InChI=1S/C17H16FNO3/c1-21-15-7-12-11(10-5-3-4-6-13(10)18)8-17(20)19-14(12)9-16(15)22-2/h3-7,9,11H,8H2,1-2H3,(H,19,20)/t11-/m0/s1

InChI Key

AIZDGFKWVSUDOM-NSHDSACASA-N

MDL Number (MFCD)

MFCD03632560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.411

Distribution Coefficient, logD

2.411

Water Solubility, LogSw

-3.06

Polar Surface Area

40.048

Acid Dissociation Constant (pKa)

11.29

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

8013-2741 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8013-2741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-2741?
Check Price and Availability of 8013-2741, 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 8013-2741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-2741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-2741
  • 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 8013-2741 available by request