Y031-9123 Screening compound: phenyl-N-[3-(trifluoromethyl)phenyl]methanesulfonamide

Y031-9123 Screening compound: phenyl-N-[3-(trifluoromethyl)phenyl]methanesulfonamide
Y031-9123 Screening compound: phenyl-N-[3-(trifluoromethyl)phenyl]methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-9123
phenyl-N-[3-(trifluoromethyl)phenyl]methanesulfonamide

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

Y031-9123

Molecular Formula

C14H12F3NO2S (C14 H12 F3 NO2 S)

Compound Name

phenyl-N-[3-(trifluoromethyl)phenyl]methanesulfonamide

IUPAC name

1-phenyl-N-[3-(trifluoromethyl)phenyl]methanesulfonamide

SMILES

O=S(Cc1ccccc1)(Nc1cc(C(F)(F)F)ccc1)=O

InChI

InChI=1S/C14H12F3NO2S/c15-14(16,17)12-7-4-8-13(9-12)18-21(19,20)10-11-5-2-1-3-6-11/h1-9,18H,10H2

InChI Key

MZPBTYRBUIFHEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01214276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.876

Distribution Coefficient, logD

2.741

Water Solubility, LogSw

-4.18

Polar Surface Area

42.515

Acid Dissociation Constant (pKa)

6.30

Base Dissociation Constant (pKb)

-9.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.29

Y031-9123 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y031-9123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-9123?
Check Price and Availability of Y031-9123, 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 Y031-9123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-9123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-9123
  • 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 Y031-9123 available by request