Y206-1289 Screening compound: ethyl 2-{[4-ethyl-5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

Y206-1289 Screening compound: ethyl 2-{[4-ethyl-5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Y206-1289 Screening compound: ethyl 2-{[4-ethyl-5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-1289
ethyl 2-{[4-ethyl-5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

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

Y206-1289

Molecular Formula

C13H16N4O2S (C13 H16 N4 O2 S)

Compound Name

ethyl 2-{[4-ethyl-5-(3-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

IUPAC name

ethyl 2-{[4-ethyl-5-(pyridin-3-yl)-4H-124-triazol-3-yl]sulfanyl}acetate

SMILES

CCn1c(SCC(OCC)=O)nnc1-c1cnccc1

InChI

InChI=1S/C13H16N4O2S/c1-3-17-12(10-6-5-7-14-8-10)15-16-13(17)20-9-11(18)19-4-2/h5-8H,3-4,9H2,1-2H3

InChI Key

XSZARZCOZJABNO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.560

Distribution Coefficient, logD

1.543

Water Solubility, LogSw

-1.45

Polar Surface Area

53.914

Acid Dissociation Constant (pKa)

19.03

Base Dissociation Constant (pKb)

5.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.46

References: we are preparing a list of scientific research reports with Y206-1289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-1289?
Check Price and Availability of Y206-1289, 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 Y206-1289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-1289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-1289
  • 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 Y206-1289 available by request