C791-0377 Screening compound: N-[(3-chlorophenyl)methyl]-2-(thiophen-2-yl)acetamide

C791-0377 Screening compound: N-[(3-chlorophenyl)methyl]-2-(thiophen-2-yl)acetamide
C791-0377 Screening compound: N-[(3-chlorophenyl)methyl]-2-(thiophen-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C791-0377
N-[(3-chlorophenyl)methyl]-2-(thiophen-2-yl)acetamide

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

C791-0377

Molecular Formula

C13H12ClNOS (C13 H12 ClNOS)

Compound Name

N-[(3-chlorophenyl)methyl]-2-(thiophen-2-yl)acetamide

IUPAC name

N-[(3-chlorophenyl)methyl]-2-(thiophen-2-yl)acetamide

SMILES

O=C(Cc1cccs1)NCc1cccc(Cl)c1

InChI

InChI=1S/C13H12ClNOS/c14-11-4-1-3-10(7-11)9-15-13(16)8-12-5-2-6-17-12/h1-7H,8-9H2,(H,15,16)

InChI Key

LXHGPTLSFNAXKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04558377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.76

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.793

Distribution Coefficient, logD

2.793

Water Solubility, LogSw

-3.33

Polar Surface Area

25.457

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

C791-0377 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

Antiviral Annotated Library (21441 compounds)

CORONAVIRUS Library (20774 compounds)

Cardiovascular Library (22201 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C791-0377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C791-0377?
Check Price and Availability of C791-0377, 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 C791-0377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C791-0377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C791-0377
  • 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 C791-0377 available by request