F835-0504 Screening compound: methyl 2-{[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate

F835-0504 Screening compound: methyl 2-{[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
F835-0504 Screening compound: methyl 2-{[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F835-0504
methyl 2-{[2-(4-ethylphenyl)-4-oxo-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

F835-0504

Molecular Formula

C16H16N4O3S (C16 H16 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCc(cc1)ccc1-c(cc12)nn1C(SCC(OC)=O)=NNC2=O

InChI

InChI=1S/C16H16N4O3S/c1-3-10-4-6-11(7-5-10)12-8-13-15(22)17-18-16(20(13)19-12)24-9-14(21)23-2/h4-8H,3,9H2,1-2H3,(H,17,22)

InChI Key

ZLVKVLCOVMOVRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27198062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.39

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

3.037

Distribution Coefficient, logD

3.036

Water Solubility, LogSw

-3.34

Polar Surface Area

72.165

Acid Dissociation Constant (pKa)

9.85

Base Dissociation Constant (pKb)

2.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with F835-0504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F835-0504?
Check Price and Availability of F835-0504, 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 F835-0504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F835-0504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F835-0504
  • 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 F835-0504 available by request