2043-2299 Screening compound: 2-oxo-N-[3-(trifluoromethyl)phenyl]-2H-chromene-3-carboxamide

2043-2299 Screening compound: 2-oxo-N-[3-(trifluoromethyl)phenyl]-2H-chromene-3-carboxamide
2043-2299 Screening compound: 2-oxo-N-[3-(trifluoromethyl)phenyl]-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2043-2299
2-oxo-N-[3-(trifluoromethyl)phenyl]-2H-chromene-3-carboxamide

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

2043-2299

Molecular Formula

C17H10F3NO3 (C17 H10 F3 NO3)

Compound Name

2-oxo-N-[3-(trifluoromethyl)phenyl]-2H-chromene-3-carboxamide

IUPAC name

2-oxo-N-[3-(trifluoromethyl)phenyl]-2H-chromene-3-carboxamide

SMILES

O=C(C1=Cc(cccc2)c2OC1=O)Nc1cccc(C(F)(F)F)c1

InChI

InChI=1S/C17H10F3NO3/c18-17(19,20)11-5-3-6-12(9-11)21-15(22)13-8-10-4-1-2-7-14(10)24-16(13)23/h1-9H,(H,21,22)

InChI Key

JXUJVKNPEQUAAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00584200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.921

Distribution Coefficient, logD

3.666

Water Solubility, LogSw

-4.36

Polar Surface Area

44.251

Acid Dissociation Constant (pKa)

7.50

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

2043-2299 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Serine Proteases Inhibitors Library (32732 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 2043-2299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2043-2299?
Check Price and Availability of 2043-2299, 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 2043-2299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2043-2299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2043-2299
  • 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 2043-2299 available by request