F835-0210 Screening compound: 2-(4-methylphenyl)-7-[({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one

F835-0210 Screening compound: 2-(4-methylphenyl)-7-[({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one
F835-0210 Screening compound: 2-(4-methylphenyl)-7-[({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F835-0210
2-(4-methylphenyl)-7-[({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one

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

F835-0210

Molecular Formula

C21H16N6O2S (C21 H16 N6 O2 S)

Compound Name

2-(4-methylphenyl)-7-[({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one

IUPAC name

2-(4-methylphenyl)-7-[({4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)sulfanyl]-4H5H-pyrazolo[15-d][124]triazin-4-one

SMILES

Cc(cc1)ccc1-c(cc12)nn1C(SCC(N=C1N3C=CC=C1)=CC3=O)=NNC2=O

InChI

InChI=1S/C21H16N6O2S/c1-13-5-7-14(8-6-13)16-11-17-20(29)23-24-21(27(17)25-16)30-12-15-10-19(28)26-9-3-2-4-18(26)22-15/h2-11H,12H2,1H3,(H,23,29)

InChI Key

UHSCCKLJYLZMTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197979

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.007

Distribution Coefficient, logD

3.004

Water Solubility, LogSw

-3.34

Polar Surface Area

77.301

Acid Dissociation Constant (pKa)

9.59

Base Dissociation Constant (pKb)

2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

F835-0210 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F835-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of F835-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F835-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F835-0210
  • 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 F835-0210 available by request