4327-3015 Screening compound: 2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]acetamide

4327-3015 Screening compound: 2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]acetamide
4327-3015 Screening compound: 2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4327-3015
2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-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

4327-3015

Molecular Formula

C11H13N3OS (C11 H13 N3 OS)

Compound Name

2-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]acetamide

IUPAC name

2-[2-(ethylsulfanyl)-1H-13-benzodiazol-1-yl]acetamide

SMILES

CCSc1nc(cccc2)c2n1CC(N)=O

InChI

InChI=1S/C11H13N3OS/c1-2-16-11-13-8-5-3-4-6-9(8)14(11)7-10(12)15/h3-6H,2,7H2,1H3,(H2,12,15)

InChI Key

DSWDCDMVTNOAGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00612520

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

235.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.902

Distribution Coefficient, logD

1.897

Water Solubility, LogSw

-2.33

Polar Surface Area

44.408

Acid Dissociation Constant (pKa)

15.24

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

4327-3015 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Others
  • Ion Channels

References: we are preparing a list of scientific research reports with 4327-3015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4327-3015?
Check Price and Availability of 4327-3015, 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 4327-3015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4327-3015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4327-3015
  • 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 4327-3015 available by request