C737-0866 Screening compound: N-[3-(methylsulfanyl)phenyl]-2-(1H-pyrrol-1-yl)acetamide

C737-0866 Screening compound: N-[3-(methylsulfanyl)phenyl]-2-(1H-pyrrol-1-yl)acetamide
C737-0866 Screening compound: N-[3-(methylsulfanyl)phenyl]-2-(1H-pyrrol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C737-0866
N-[3-(methylsulfanyl)phenyl]-2-(1H-pyrrol-1-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

C737-0866

Molecular Formula

C13H14N2OS (C13 H14 N2 OS)

Compound Name

N-[3-(methylsulfanyl)phenyl]-2-(1H-pyrrol-1-yl)acetamide

IUPAC name

N-[3-(methylsulfanyl)phenyl]-2-(1H-pyrrol-1-yl)acetamide

SMILES

CSc1cc(NC(Cn2cccc2)=O)ccc1

InChI

InChI=1S/C13H14N2OS/c1-17-12-6-4-5-11(9-12)14-13(16)10-15-7-2-3-8-15/h2-9H,10H2,1H3,(H,14,16)

InChI Key

UYWSLBAMEWEPQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14790245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.032

Distribution Coefficient, logD

3.032

Water Solubility, LogSw

-3.28

Polar Surface Area

27.199

Acid Dissociation Constant (pKa)

12.24

Base Dissociation Constant (pKb)

1.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

C737-0866 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C737-0866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C737-0866?
Check Price and Availability of C737-0866, 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 C737-0866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C737-0866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C737-0866
  • 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 C737-0866 available by request