2614-0013 Screening compound: 1-cyclohexyl-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-1,2,3,4-tetrazole

2614-0013 Screening compound: 1-cyclohexyl-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-1,2,3,4-tetrazole
2614-0013 Screening compound: 1-cyclohexyl-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 2614-0013
1-cyclohexyl-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-1,2,3,4-tetrazole

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

2614-0013

Molecular Formula

C16H22N4O2S (C16 H22 N4 O2 S)

Compound Name

1-cyclohexyl-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-1,2,3,4-tetrazole

IUPAC name

1-cyclohexyl-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-1H-1234-tetrazole

SMILES

COc(cc1)ccc1OCCSc1nnnn1C1CCCCC1

InChI

InChI=1S/C16H22N4O2S/c1-21-14-7-9-15(10-8-14)22-11-12-23-16-17-18-19-20(16)13-5-3-2-4-6-13/h7-10,13H,2-6,11-12H2,1H3

InChI Key

WMKPQTTUSLAOMX-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.514

Distribution Coefficient, logD

3.514

Water Solubility, LogSw

-3.63

Polar Surface Area

54.683

Acid Dissociation Constant (pKa)

20.75

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

References: we are preparing a list of scientific research reports with 2614-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2614-0013?
Check Price and Availability of 2614-0013, 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 2614-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2614-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2614-0013
  • 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 2614-0013 available by request