Y205-9140 Screening compound: 2-chloro-4-fluoro-N~1~-isobutylbenzamide

Y205-9140 Screening compound: 2-chloro-4-fluoro-N~1~-isobutylbenzamide
Y205-9140 Screening compound: 2-chloro-4-fluoro-N~1~-isobutylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-9140
2-chloro-4-fluoro-N~1~-isobutylbenzamide

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

Y205-9140

Molecular Formula

C11H13ClFNO (C11 H13 ClFNO)

Compound Name

2-chloro-4-fluoro-N~1~-isobutylbenzamide

IUPAC name

2-chloro-4-fluoro-N-(2-methylpropyl)benzamide

SMILES

CC(C)CNC(c(ccc(F)c1)c1Cl)=O

InChI

InChI=1S/C11H13ClFNO/c1-7(2)6-14-11(15)9-4-3-8(13)5-10(9)12/h3-5,7H,6H2,1-2H3,(H,14,15)

InChI Key

OPUVOPSDQHRBQJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

229.68

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

3.237

Distribution Coefficient, logD

3.237

Water Solubility, LogSw

-3.66

Polar Surface Area

24.923

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

-2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.36

Y205-9140 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y205-9140 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-9140?
Check Price and Availability of Y205-9140, 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 Y205-9140 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-9140
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-9140
  • 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 Y205-9140 available by request