4485-0190 Screening compound: 2-methyl-3-oxo-3-phenyl-N-[3-(trifluoromethyl)phenyl]propanamide

4485-0190 Screening compound: 2-methyl-3-oxo-3-phenyl-N-[3-(trifluoromethyl)phenyl]propanamide
4485-0190 Screening compound: 2-methyl-3-oxo-3-phenyl-N-[3-(trifluoromethyl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4485-0190
2-methyl-3-oxo-3-phenyl-N-[3-(trifluoromethyl)phenyl]propanamide

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

4485-0190

Molecular Formula

C17H14F3NO2 (C17 H14 F3 NO2)

Compound Name

2-methyl-3-oxo-3-phenyl-N-[3-(trifluoromethyl)phenyl]propanamide

IUPAC name

2-methyl-3-oxo-3-phenyl-N-[3-(trifluoromethyl)phenyl]propanamide

SMILES

CC(C(c1ccccc1)=O)C(Nc1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C17H14F3NO2/c1-11(15(22)12-6-3-2-4-7-12)16(23)21-14-9-5-8-13(10-14)17(18,19)20/h2-11H,1H3,(H,21,23)/t11-/m0/s1

InChI Key

BBUJTJQWBMKJFQ-NSHDSACASA-N

MDL Number (MFCD)

MFCD00688631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.074

Distribution Coefficient, logD

4.072

Water Solubility, LogSw

-4.17

Polar Surface Area

37.068

Acid Dissociation Constant (pKa)

9.77

Base Dissociation Constant (pKb)

-1.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.60

4485-0190 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4485-0190 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4485-0190?
Check Price and Availability of 4485-0190, 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 4485-0190 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4485-0190
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4485-0190
  • 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 4485-0190 available by request