F835-0549 Screening compound: tert-butyl 2-{[4-oxo-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate

F835-0549 Screening compound: tert-butyl 2-{[4-oxo-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
F835-0549 Screening compound: tert-butyl 2-{[4-oxo-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F835-0549
tert-butyl 2-{[4-oxo-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-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

F835-0549

Molecular Formula

C15H16N4O3S2 (C15 H16 N4 O3 S2)

Compound Name

tert-butyl 2-{[4-oxo-2-(thiophen-2-yl)-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate

IUPAC name

tert-butyl 2-{[4-oxo-2-(thiophen-2-yl)-4H5H-pyrazolo[15-d][124]triazin-7-yl]sulfanyl}acetate

SMILES

CC(C)(C)OC(CSC(n(c1c2)nc2-c2cccs2)=NNC1=O)=O

InChI

InChI=1S/C15H16N4O3S2/c1-15(2,3)22-12(20)8-24-14-17-16-13(21)10-7-9(18-19(10)14)11-5-4-6-23-11/h4-7H,8H2,1-3H3,(H,16,21)

InChI Key

FLLOPNAZLTYBGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27198088

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.287

Distribution Coefficient, logD

3.285

Water Solubility, LogSw

-3.64

Polar Surface Area

71.873

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with F835-0549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F835-0549?
Check Price and Availability of F835-0549, 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 F835-0549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F835-0549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F835-0549
  • 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 F835-0549 available by request