K781-4165 Screening compound: 3-(4-bromobenzenesulfonamido)-N-(2-phenylethyl)propanamide

K781-4165 Screening compound: 3-(4-bromobenzenesulfonamido)-N-(2-phenylethyl)propanamide
K781-4165 Screening compound: 3-(4-bromobenzenesulfonamido)-N-(2-phenylethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-4165
3-(4-bromobenzenesulfonamido)-N-(2-phenylethyl)propanamide

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

K781-4165

Molecular Formula

C17H19BrN2O3S (C17 H19 BrN2 O3 S)

Compound Name

3-(4-bromobenzenesulfonamido)-N-(2-phenylethyl)propanamide

IUPAC name

3-(4-bromobenzenesulfonamido)-N-(2-phenylethyl)propanamide

SMILES

O=C(CCNS(c(cc1)ccc1Br)(=O)=O)NCCc1ccccc1

InChI

InChI=1S/C17H19BrN2O3S/c18-15-6-8-16(9-7-15)24(22,23)20-13-11-17(21)19-12-10-14-4-2-1-3-5-14/h1-9,20H,10-13H2,(H,19,21)

InChI Key

RVQRNLMMWNSHRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09432525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.828

Distribution Coefficient, logD

2.828

Water Solubility, LogSw

-3.46

Polar Surface Area

66.151

Acid Dissociation Constant (pKa)

11.26

Base Dissociation Constant (pKb)

-0.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

K781-4165 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with K781-4165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-4165?
Check Price and Availability of K781-4165, 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 K781-4165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-4165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-4165
  • 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 K781-4165 available by request