D347-0166 Screening compound: 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-N-methyl-N-phenylacetamide

D347-0166 Screening compound: 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-N-methyl-N-phenylacetamide
D347-0166 Screening compound: 2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-N-methyl-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-0166
2-(2-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)-N-methyl-N-phenylacetamide

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

D347-0166

Molecular Formula

C25H25N3O3S (C25 H25 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CN(C(Cn1c(SCCOc(cccc2)c2OC)nc2c1cccc2)=O)c1ccccc1

InChI

InChI=1S/C25H25N3O3S/c1-27(19-10-4-3-5-11-19)24(29)18-28-21-13-7-6-12-20(21)26-25(28)32-17-16-31-23-15-9-8-14-22(23)30-2/h3-15H,16-18H2,1-2H3

InChI Key

NYMNWNJZSMAFBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820971

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.140

Distribution Coefficient, logD

4.139

Water Solubility, LogSw

-4.31

Polar Surface Area

40.725

Acid Dissociation Constant (pKa)

16.64

Base Dissociation Constant (pKb)

4.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with D347-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-0166?
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What is the minimum amount of D347-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-0166
  • 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 D347-0166 available by request