8290-03000 Screening compound: N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-2-[(4-chlorophenyl)sulfanyl]acetamide

8290-03000 Screening compound: N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-2-[(4-chlorophenyl)sulfanyl]acetamide
8290-03000 Screening compound: N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-2-[(4-chlorophenyl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8290-03000
N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-2-[(4-chlorophenyl)sulfanyl]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

8290-03000

Molecular Formula

C21H16ClN3OS (C21 H16 ClN3 OS)

Compound Name

N-[3-(1H-1,3-benzodiazol-2-yl)phenyl]-2-[(4-chlorophenyl)sulfanyl]acetamide

IUPAC name

N-[3-(1H-13-benzodiazol-2-yl)phenyl]-2-[(4-chlorophenyl)sulfanyl]acetamide

SMILES

O=C(CSc(cc1)ccc1Cl)Nc1cc(-c2nc(cccc3)c3[nH]2)ccc1

InChI

InChI=1S/C21H16ClN3OS/c22-15-8-10-17(11-9-15)27-13-20(26)23-16-5-3-4-14(12-16)21-24-18-6-1-2-7-19(18)25-21/h1-12H,13H2,(H,23,26)(H,24,25)

InChI Key

OLKGQFJZKSFYKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03780199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.774

Distribution Coefficient, logD

5.774

Water Solubility, LogSw

-6.10

Polar Surface Area

42.136

Acid Dissociation Constant (pKa)

10.71

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

8290-03000 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Human Ion Channels Annotated Library (353 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8290-03000 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8290-03000?
Check Price and Availability of 8290-03000, 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 8290-03000 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8290-03000
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8290-03000
  • 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 8290-03000 available by request