K786-8844 Screening compound: 1-cyclohexyl-N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

K786-8844 Screening compound: 1-cyclohexyl-N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide
K786-8844 Screening compound: 1-cyclohexyl-N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-8844
1-cyclohexyl-N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

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

K786-8844

Molecular Formula

C23H34N4O (C23 H34 N4 O)

Compound Name

1-cyclohexyl-N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

1-cyclohexyl-N-[2-(26-dimethylpiperidin-1-yl)ethyl]-1H-13-benzodiazole-5-carboxamide

SMILES

CC1N(CCNC(c(cc2)cc3c2n(C2CCCCC2)cn3)=O)C(C)CCC1

InChI

InChI=1S/C23H34N4O/c1-17-7-6-8-18(2)26(17)14-13-24-23(28)19-11-12-22-21(15-19)25-16-27(22)20-9-4-3-5-10-20/h11-12,15-18,20H,3-10,13-14H2,1-2H3,(H,24,28)

InChI Key

ZSANJFUGFUNHSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15102028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.741

Distribution Coefficient, logD

2.267

Water Solubility, LogSw

-3.83

Polar Surface Area

37.508

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

8.86

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

65.20

K786-8844 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Eye
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K786-8844 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-8844?
Check Price and Availability of K786-8844, 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 K786-8844 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-8844
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-8844
  • 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 K786-8844 available by request