5241-0406 Screening compound: N-(3-methylphenyl)-2-[3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl]acetamide

5241-0406 Screening compound: N-(3-methylphenyl)-2-[3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl]acetamide
5241-0406 Screening compound: N-(3-methylphenyl)-2-[3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5241-0406
N-(3-methylphenyl)-2-[3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl]acetamide

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

5241-0406

Molecular Formula

C19H15F3N2O2 (C19 H15 F3 N2 O2)

Compound Name

N-(3-methylphenyl)-2-[3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl]acetamide

IUPAC name

N-(3-methylphenyl)-2-[3-(222-trifluoroacetyl)-1H-indol-1-yl]acetamide

SMILES

Cc1cccc(NC(Cn2c(cccc3)c3c(C(C(F)(F)F)=O)c2)=O)c1

InChI

InChI=1S/C19H15F3N2O2/c1-12-5-4-6-13(9-12)23-17(25)11-24-10-15(18(26)19(20,21)22)14-7-2-3-8-16(14)24/h2-10H,11H2,1H3,(H,23,25)

InChI Key

HPSFYNDNYDCECG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827204

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.292

Distribution Coefficient, logD

4.292

Water Solubility, LogSw

-4.22

Polar Surface Area

38.859

Acid Dissociation Constant (pKa)

12.55

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

5241-0406 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 5241-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5241-0406?
Check Price and Availability of 5241-0406, 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 5241-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5241-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5241-0406
  • 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 5241-0406 available by request