8010-0514 Screening compound: 5-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole

8010-0514 Screening compound: 5-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole
8010-0514 Screening compound: 5-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-0514
5-{[2-(3,4-dimethylphenoxy)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

8010-0514

Molecular Formula

C17H18N4OS (C17 H18 N4 OS)

Compound Name

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

IUPAC name

5-{[2-(34-dimethylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-1234-tetrazole

SMILES

Cc(cc1)c(C)cc1OCCSc1nnnn1-c1ccccc1

InChI

InChI=1S/C17H18N4OS/c1-13-8-9-16(12-14(13)2)22-10-11-23-17-18-19-20-21(17)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3

InChI Key

VEINBDTWJZYCRJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00806231

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.42

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

4.287

Distribution Coefficient, logD

4.287

Water Solubility, LogSw

-4.27

Polar Surface Area

47.307

Acid Dissociation Constant (pKa)

25.46

Base Dissociation Constant (pKb)

-2.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 8010-0514 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-0514?
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What is the minimum amount of 8010-0514 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-0514
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-0514
  • 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 8010-0514 available by request