D347-0159 Screening compound: methyl 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetate

D347-0159 Screening compound: methyl 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetate
D347-0159 Screening compound: methyl 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-0159
methyl 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetate

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

D347-0159

Molecular Formula

C19H20N2O4S (C19 H20 N2 O4 S)

Compound Name

methyl 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetate

IUPAC name

methyl 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-13-benzodiazol-1-yl)acetate

SMILES

COC(Cn1c(SCCOc(cccc2)c2OC)nc2c1cccc2)=O

InChI

InChI=1S/C19H20N2O4S/c1-23-16-9-5-6-10-17(16)25-11-12-26-19-20-14-7-3-4-8-15(14)21(19)13-18(22)24-2/h3-10H,11-13H2,1-2H3

InChI Key

ZGODQAYPIDXSEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09361167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.428

Distribution Coefficient, logD

3.424

Water Solubility, LogSw

-3.69

Polar Surface Area

46.463

Acid Dissociation Constant (pKa)

17.83

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D347-0159 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D347-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-0159?
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What is the minimum amount of D347-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-0159
  • 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 D347-0159 available by request