F487-0223 Screening compound: 3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-[(piperidin-1-yl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione

F487-0223 Screening compound: 3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-[(piperidin-1-yl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione
F487-0223 Screening compound: 3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-[(piperidin-1-yl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound F487-0223
3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-[(piperidin-1-yl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione

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

F487-0223

Molecular Formula

C22H26N4O2S (C22 H26 N4 O2 S)

Compound Name

3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-[(piperidin-1-yl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione

IUPAC name

3-[(4-methoxyphenoxy)methyl]-4-phenyl-1-[(piperidin-1-yl)methyl]-45-dihydro-1H-124-triazole-5-thione

SMILES

COc(cc1)ccc1OCC(N1c2ccccc2)=NN(CN2CCCCC2)C1=S

InChI

InChI=1S/C22H26N4O2S/c1-27-19-10-12-20(13-11-19)28-16-21-23-25(17-24-14-6-3-7-15-24)22(29)26(21)18-8-4-2-5-9-18/h2,4-5,8-13H,3,6-7,14-17H2,1H3

InChI Key

HEEOAHBYUOEZFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03087970

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.54

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

3.771

Distribution Coefficient, logD

1.097

Water Solubility, LogSw

-3.90

Polar Surface Area

38.552

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

10.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with F487-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F487-0223?
Check Price and Availability of F487-0223, 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 F487-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F487-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F487-0223
  • 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 F487-0223 available by request