K906-0789 Screening compound: 5-bromo-N-cyclohexyl-N-methyl-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide

K906-0789 Screening compound: 5-bromo-N-cyclohexyl-N-methyl-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
K906-0789 Screening compound: 5-bromo-N-cyclohexyl-N-methyl-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-0789
5-bromo-N-cyclohexyl-N-methyl-1-propanoyl-2,3-dihydro-1H-indole-6-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

K906-0789

Molecular Formula

C18H25BrN2O3S (C18 H25 BrN2 O3 S)

Compound Name

5-bromo-N-cyclohexyl-N-methyl-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide

IUPAC name

5-bromo-N-cyclohexyl-N-methyl-1-propanoyl-23-dihydro-1H-indole-6-sulfonamide

SMILES

CCC(N(CCc1c2)c1cc(S(N(C)C1CCCCC1)(=O)=O)c2Br)=O

InChI

InChI=1S/C18H25BrN2O3S/c1-3-18(22)21-10-9-13-11-15(19)17(12-16(13)21)25(23,24)20(2)14-7-5-4-6-8-14/h11-12,14H,3-10H2,1-2H3

InChI Key

SQLZQPPXVNKCQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15112213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.147

Distribution Coefficient, logD

4.147

Water Solubility, LogSw

-4.09

Polar Surface Area

48.316

Acid Dissociation Constant (pKa)

22.26

Base Dissociation Constant (pKb)

-2.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

K906-0789 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K906-0789 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-0789?
Check Price and Availability of K906-0789, 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 K906-0789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-0789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-0789
  • 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 K906-0789 available by request