K781-4179 Screening compound: 3-(4-bromobenzenesulfonamido)-N-cyclohexylpropanamide

K781-4179 Screening compound: 3-(4-bromobenzenesulfonamido)-N-cyclohexylpropanamide
K781-4179 Screening compound: 3-(4-bromobenzenesulfonamido)-N-cyclohexylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-4179
3-(4-bromobenzenesulfonamido)-N-cyclohexylpropanamide

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

K781-4179

Molecular Formula

C15H21BrN2O3S (C15 H21 BrN2 O3 S)

Compound Name

3-(4-bromobenzenesulfonamido)-N-cyclohexylpropanamide

IUPAC name

3-(4-bromobenzenesulfonamido)-N-cyclohexylpropanamide

SMILES

O=C(CCNS(c(cc1)ccc1Br)(=O)=O)NC1CCCCC1

InChI

InChI=1S/C15H21BrN2O3S/c16-12-6-8-14(9-7-12)22(20,21)17-11-10-15(19)18-13-4-2-1-3-5-13/h6-9,13,17H,1-5,10-11H2,(H,18,19)

InChI Key

BJCTVUADMPXWLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02937336

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.397

Distribution Coefficient, logD

3.397

Water Solubility, LogSw

-3.76

Polar Surface Area

66.035

Acid Dissociation Constant (pKa)

11.26

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

K781-4179 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with K781-4179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-4179?
Check Price and Availability of K781-4179, 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 K781-4179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-4179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-4179
  • 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 K781-4179 available by request