D347-0319 Screening compound: 2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1-(prop-2-en-1-yl)-1H-1,3-benzodiazole

D347-0319 Screening compound: 2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1-(prop-2-en-1-yl)-1H-1,3-benzodiazole
D347-0319 Screening compound: 2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1-(prop-2-en-1-yl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D347-0319
2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1-(prop-2-en-1-yl)-1H-1,3-benzodiazole

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

D347-0319

Molecular Formula

C19H20N2OS (C19 H20 N2 OS)

Compound Name

2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1-(prop-2-en-1-yl)-1H-1,3-benzodiazole

IUPAC name

2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1-(prop-2-en-1-yl)-1H-13-benzodiazole

SMILES

Cc1cccc(OCCSc2nc(cccc3)c3n2CC=C)c1

InChI

InChI=1S/C19H20N2OS/c1-3-11-21-18-10-5-4-9-17(18)20-19(21)23-13-12-22-16-8-6-7-15(2)14-16/h3-10,14H,1,11-13H2,2H3

InChI Key

QAVVXVFGIUHVHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820976

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.212

Distribution Coefficient, logD

5.212

Water Solubility, LogSw

-5.10

Polar Surface Area

18.145

Acid Dissociation Constant (pKa)

25.68

Base Dissociation Constant (pKb)

4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with D347-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D347-0319?
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What is the minimum amount of D347-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D347-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D347-0319
  • 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 D347-0319 available by request