K834-0536 Screening compound: 5-(2,3-dihydro-1H-indole-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]benzamide

K834-0536 Screening compound: 5-(2,3-dihydro-1H-indole-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]benzamide
K834-0536 Screening compound: 5-(2,3-dihydro-1H-indole-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K834-0536
5-(2,3-dihydro-1H-indole-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]benzamide

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

K834-0536

Molecular Formula

C31H29FN2O5S2 (C31 H29 FN2 O5 S2)

Compound Name

5-(2,3-dihydro-1H-indole-1-sulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]benzamide

IUPAC name

5-(23-dihydro-1H-indole-1-sulfonyl)-N-[2-(34-dimethoxyphenyl)ethyl]-2-[(4-fluorophenyl)sulfanyl]benzamide

SMILES

COc(ccc(CCNC(c(cc(cc1)S(N(CC2)c3c2cccc3)(=O)=O)c1Sc(cc1)ccc1F)=O)c1)c1OC

InChI

InChI=1S/C31H29FN2O5S2/c1-38-28-13-7-21(19-29(28)39-2)15-17-33-31(35)26-20-25(12-14-30(26)40-24-10-8-23(32)9-11-24)41(36,37)34-18-16-22-5-3-4-6-27(22)34/h3-14,19-20H,15-18H2,1-2H3,(H,33,35)

InChI Key

IUXJTWOIDIGEKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04422210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

592.71

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.635

Distribution Coefficient, logD

5.635

Water Solubility, LogSw

-5.43

Polar Surface Area

71.001

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

-5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.40

K834-0536 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

MCL1 Targeted Library (12200 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K834-0536 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K834-0536?
Check Price and Availability of K834-0536, 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 K834-0536 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K834-0536
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K834-0536
  • 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 K834-0536 available by request