K786-0884 Screening compound: N-benzyl-5-(dibutylsulfamoyl)-3-methyl-1-benzofuran-2-carboxamide

K786-0884 Screening compound: N-benzyl-5-(dibutylsulfamoyl)-3-methyl-1-benzofuran-2-carboxamide
K786-0884 Screening compound: N-benzyl-5-(dibutylsulfamoyl)-3-methyl-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-0884
N-benzyl-5-(dibutylsulfamoyl)-3-methyl-1-benzofuran-2-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

K786-0884

Molecular Formula

C25H32N2O4S (C25 H32 N2 O4 S)

Compound Name

N-benzyl-5-(dibutylsulfamoyl)-3-methyl-1-benzofuran-2-carboxamide

IUPAC name

N-benzyl-5-(dibutylsulfamoyl)-3-methyl-1-benzofuran-2-carboxamide

SMILES

CCCCN(CCCC)S(c(cc1)cc2c1oc(C(NCc1ccccc1)=O)c2C)(=O)=O

InChI

InChI=1S/C25H32N2O4S/c1-4-6-15-27(16-7-5-2)32(29,30)21-13-14-23-22(17-21)19(3)24(31-23)25(28)26-18-20-11-9-8-10-12-20/h8-14,17H,4-7,15-16,18H2,1-3H3,(H,26,28)

InChI Key

GQLUCYNRFFZWBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15099912

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.862

Distribution Coefficient, logD

5.862

Water Solubility, LogSw

-5.43

Polar Surface Area

64.781

Acid Dissociation Constant (pKa)

11.41

Base Dissociation Constant (pKb)

-1.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

K786-0884 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K786-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-0884?
Check Price and Availability of K786-0884, 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 K786-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-0884
  • 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 K786-0884 available by request