D347-0210 Screening compound: 2-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

D347-0210 Screening compound: 2-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-1-(piperidin-1-yl)ethan-1-one
D347-0210 Screening compound: 2-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-1-(piperidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-0210
2-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

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

D347-0210

Molecular Formula

C22H24ClN3O2S (C22 H24 ClN3 O2 S)

Compound Name

2-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

IUPAC name

2-(2-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-1H-13-benzodiazol-1-yl)-1-(piperidin-1-yl)ethan-1-one

SMILES

O=C(Cn1c(SCCOc(cccc2)c2Cl)nc2c1cccc2)N1CCCCC1

InChI

InChI=1S/C22H24ClN3O2S/c23-17-8-2-5-11-20(17)28-14-15-29-22-24-18-9-3-4-10-19(18)26(22)16-21(27)25-12-6-1-7-13-25/h2-5,8-11H,1,6-7,12-16H2

InChI Key

PZBVXYDVWRWYEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09759619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.540

Distribution Coefficient, logD

4.534

Water Solubility, LogSw

-4.49

Polar Surface Area

34.374

Acid Dissociation Constant (pKa)

18.80

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

D347-0210 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D347-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-0210?
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What is the minimum amount of D347-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-0210
  • 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 D347-0210 available by request