K781-4977 Screening compound: 6-(4-bromobenzenesulfonamido)-N-butylhexanamide

K781-4977 Screening compound: 6-(4-bromobenzenesulfonamido)-N-butylhexanamide
K781-4977 Screening compound: 6-(4-bromobenzenesulfonamido)-N-butylhexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-4977
6-(4-bromobenzenesulfonamido)-N-butylhexanamide

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

K781-4977

Molecular Formula

C16H25BrN2O3S (C16 H25 BrN2 O3 S)

Compound Name

6-(4-bromobenzenesulfonamido)-N-butylhexanamide

IUPAC name

6-(4-bromobenzenesulfonamido)-N-butylhexanamide

SMILES

CCCCNC(CCCCCNS(c(cc1)ccc1Br)(=O)=O)=O

InChI

InChI=1S/C16H25BrN2O3S/c1-2-3-12-18-16(20)7-5-4-6-13-19-23(21,22)15-10-8-14(17)9-11-15/h8-11,19H,2-7,12-13H2,1H3,(H,18,20)

InChI Key

IEKUUEKCAMLMGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02937434

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.362

Distribution Coefficient, logD

3.361

Water Solubility, LogSw

-3.56

Polar Surface Area

66.423

Acid Dissociation Constant (pKa)

11.49

Base Dissociation Constant (pKb)

0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

K781-4977 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Dark Chemical Matter Library (18430 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Structure:
  • Pool
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with K781-4977 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-4977?
Check Price and Availability of K781-4977, 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 K781-4977 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-4977
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-4977
  • 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 K781-4977 available by request