8010-0510 Screening compound: 5-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole

8010-0510 Screening compound: 5-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole
8010-0510 Screening compound: 5-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-0510
5-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1-phenyl-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

8010-0510

Molecular Formula

C16H16N4OS (C16 H16 N4 OS)

Compound Name

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

IUPAC name

5-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1234-tetrazole

SMILES

Cc(cccc1)c1OCCSc1nnnn1-c1ccccc1

InChI

InChI=1S/C16H16N4OS/c1-13-7-5-6-10-15(13)21-11-12-22-16-17-18-19-20(16)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3

InChI Key

BQUAFTQHWNALJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01446084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.662

Distribution Coefficient, logD

3.662

Water Solubility, LogSw

-3.87

Polar Surface Area

47.393

Acid Dissociation Constant (pKa)

25.46

Base Dissociation Constant (pKb)

-2.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

References: we are preparing a list of scientific research reports with 8010-0510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-0510?
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What is the minimum amount of 8010-0510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-0510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-0510
  • 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 8010-0510 available by request