4327-3120 Screening compound: 2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1-methyl-1H-1,3-benzodiazole

4327-3120 Screening compound: 2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1-methyl-1H-1,3-benzodiazole
4327-3120 Screening compound: 2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1-methyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4327-3120
2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1-methyl-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

4327-3120

Molecular Formula

C17H18N2O2S (C17 H18 N2 O2 S)

Compound Name

2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1-methyl-1H-1,3-benzodiazole

IUPAC name

2-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1-methyl-1H-13-benzodiazole

SMILES

Cn1c(SCCOc(cc2)ccc2OC)nc2c1cccc2

InChI

InChI=1S/C17H18N2O2S/c1-19-16-6-4-3-5-15(16)18-17(19)22-12-11-21-14-9-7-13(20-2)8-10-14/h3-10H,11-12H2,1-2H3

InChI Key

PFXZMFSNIMPSTN-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.852

Distribution Coefficient, logD

3.847

Water Solubility, LogSw

-4.02

Polar Surface Area

26.520

Acid Dissociation Constant (pKa)

25.68

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 4327-3120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4327-3120?
Check Price and Availability of 4327-3120, 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 4327-3120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4327-3120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4327-3120
  • 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 4327-3120 available by request