G856-4562 Screening compound: N-(3-acetamidophenyl)-4-(thiophen-2-yl)oxane-4-carboxamide

G856-4562 Screening compound: N-(3-acetamidophenyl)-4-(thiophen-2-yl)oxane-4-carboxamide
G856-4562 Screening compound: N-(3-acetamidophenyl)-4-(thiophen-2-yl)oxane-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-4562
N-(3-acetamidophenyl)-4-(thiophen-2-yl)oxane-4-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

G856-4562

Molecular Formula

C18H20N2O3S (C18 H20 N2 O3 S)

Compound Name

N-(3-acetamidophenyl)-4-(thiophen-2-yl)oxane-4-carboxamide

IUPAC name

N-(3-acetamidophenyl)-4-(thiophen-2-yl)oxane-4-carboxamide

SMILES

CC(Nc1cccc(NC(C2(CCOCC2)c2cccs2)=O)c1)=O

InChI

InChI=1S/C18H20N2O3S/c1-13(21)19-14-4-2-5-15(12-14)20-17(22)18(7-9-23-10-8-18)16-6-3-11-24-16/h2-6,11-12H,7-10H2,1H3,(H,19,21)(H,20,22)

InChI Key

VPDMSZXGKGPHEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06406822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.747

Distribution Coefficient, logD

2.747

Water Solubility, LogSw

-3.18

Polar Surface Area

55.439

Acid Dissociation Constant (pKa)

12.18

Base Dissociation Constant (pKb)

-0.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G856-4562 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 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

References: we are preparing a list of scientific research reports with G856-4562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-4562?
Check Price and Availability of G856-4562, 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 G856-4562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-4562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-4562
  • 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 G856-4562 available by request