K786-8770 Screening compound: 1-cyclooctyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

K786-8770 Screening compound: 1-cyclooctyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide
K786-8770 Screening compound: 1-cyclooctyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-8770
1-cyclooctyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-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

K786-8770

Molecular Formula

C23H34N2O4 (C23 H34 N2 O4)

Compound Name

1-cyclooctyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

IUPAC name

1-cyclooctyl-N-[2-(34-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

SMILES

COc(ccc(CCNC(C(C1)CN(C2CCCCCCC2)C1=O)=O)c1)c1OC

InChI

InChI=1S/C23H34N2O4/c1-28-20-11-10-17(14-21(20)29-2)12-13-24-23(27)18-15-22(26)25(16-18)19-8-6-4-3-5-7-9-19/h10-11,14,18-19H,3-9,12-13,15-16H2,1-2H3,(H,24,27)/t18-/m1/s1

InChI Key

HWGCWLBRCXETEF-GOSISDBHSA-N

MDL Number (MFCD)

MFCD15101991

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.877

Distribution Coefficient, logD

2.877

Water Solubility, LogSw

-3.11

Polar Surface Area

56.668

Acid Dissociation Constant (pKa)

13.79

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.20

K786-8770 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Annotated Library (688 compounds)

Dark Chemical Matter Library (18430 compounds)

Human GPCR Annotated Library (5539 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Beyond the Flatland Library sp3 enriched (92988 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
  • Pool
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with K786-8770 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-8770?
Check Price and Availability of K786-8770, 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 K786-8770 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-8770
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-8770
  • 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 K786-8770 available by request