Y203-9594 Screening compound: N~1~-[2-(trifluoromethyl)phenyl]-1-cyclopentanecarboxamide

Y203-9594 Screening compound: N~1~-[2-(trifluoromethyl)phenyl]-1-cyclopentanecarboxamide
Y203-9594 Screening compound: N~1~-[2-(trifluoromethyl)phenyl]-1-cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y203-9594
N~1~-[2-(trifluoromethyl)phenyl]-1-cyclopentanecarboxamide

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

Y203-9594

Molecular Formula

C13H14F3NO (C13 H14 F3 NO)

Compound Name

N~1~-[2-(trifluoromethyl)phenyl]-1-cyclopentanecarboxamide

IUPAC name

N-[2-(trifluoromethyl)phenyl]cyclopentanecarboxamide

SMILES

O=C(C1CCCC1)Nc1c(C(F)(F)F)cccc1

InChI

InChI=1S/C13H14F3NO/c14-13(15,16)10-7-3-4-8-11(10)17-12(18)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H,17,18)

InChI Key

XLCMBNFBHZIBFQ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

257.26

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.604

Distribution Coefficient, logD

3.604

Water Solubility, LogSw

-3.81

Polar Surface Area

23.190

Acid Dissociation Constant (pKa)

11.84

Base Dissociation Constant (pKb)

-0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

Y203-9594 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 Y203-9594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y203-9594?
Check Price and Availability of Y203-9594, 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 Y203-9594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y203-9594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y203-9594
  • 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 Y203-9594 available by request