0254-0530 Screening compound: 4-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzene-1-sulfonamide

0254-0530 Screening compound: 4-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzene-1-sulfonamide
0254-0530 Screening compound: 4-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0254-0530
4-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzene-1-sulfonamide

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

0254-0530

Molecular Formula

C15H19ClN2O2S (C15 H19 ClN2 O2 S)

Compound Name

4-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzene-1-sulfonamide

IUPAC name

4-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzene-1-sulfonamide

SMILES

N#CCCN(C1CCCCC1)S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C15H19ClN2O2S/c16-13-7-9-15(10-8-13)21(19,20)18(12-4-11-17)14-5-2-1-3-6-14/h7-10,14H,1-6,12H2

InChI Key

OKNDUAOCSBCEJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00552885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.563

Distribution Coefficient, logD

3.563

Water Solubility, LogSw

-3.88

Polar Surface Area

49.367

Acid Dissociation Constant (pKa)

22.31

Base Dissociation Constant (pKb)

-4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

0254-0530 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0254-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0254-0530?
Check Price and Availability of 0254-0530, 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 0254-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0254-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0254-0530
  • 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 0254-0530 available by request