K786-7208 Screening compound: 8-{[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane

K786-7208 Screening compound: 8-{[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane
K786-7208 Screening compound: 8-{[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-7208
8-{[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane

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

K786-7208

Molecular Formula

C25H37N3O5S (C25 H37 N3 O5 S)

Compound Name

8-{[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-{[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]sulfonyl}-14-dioxa-8-azaspiro[4.5]decane

SMILES

O=C(C(CC1)CCN1S(N(CC1)CCC11OCCO1)(=O)=O)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C25H37N3O5S/c29-24(26-12-6-22(7-13-26)20-21-4-2-1-3-5-21)23-8-14-27(15-9-23)34(30,31)28-16-10-25(11-17-28)32-18-19-33-25/h1-5,22-23H,6-20H2

InChI Key

UHWQCEPDAVOTFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15101661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.65

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.734

Distribution Coefficient, logD

2.734

Water Solubility, LogSw

-3.11

Polar Surface Area

65.169

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

0.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.00

K786-7208 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

GPCR Targeted Library (31838 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • GPCR
  • Proteases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K786-7208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-7208?
Check Price and Availability of K786-7208, 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 K786-7208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-7208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-7208
  • 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 K786-7208 available by request