F835-0482 Screening compound: 1-[4-({[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}methyl)phenyl]pyrrolidin-2-one

F835-0482 Screening compound: 1-[4-({[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}methyl)phenyl]pyrrolidin-2-one
F835-0482 Screening compound: 1-[4-({[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}methyl)phenyl]pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F835-0482
1-[4-({[2-(4-ethylphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}methyl)phenyl]pyrrolidin-2-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

F835-0482

Molecular Formula

C24H23N5O2S (C24 H23 N5 O2 S)

Compound Name

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

IUPAC name

1-[4-({[2-(4-ethylphenyl)-4-oxo-4H5H-pyrazolo[15-d][124]triazin-7-yl]sulfanyl}methyl)phenyl]pyrrolidin-2-one

SMILES

CCc(cc1)ccc1-c(cc12)nn1C(SCc(cc1)ccc1N(CCC1)C1=O)=NNC2=O

InChI

InChI=1S/C24H23N5O2S/c1-2-16-5-9-18(10-6-16)20-14-21-23(31)25-26-24(29(21)27-20)32-15-17-7-11-19(12-8-17)28-13-3-4-22(28)30/h5-12,14H,2-4,13,15H2,1H3,(H,25,31)

InChI Key

DSCZOEJJNVYSJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27198052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.529

Distribution Coefficient, logD

4.528

Water Solubility, LogSw

-4.20

Polar Surface Area

68.131

Acid Dissociation Constant (pKa)

10.00

Base Dissociation Constant (pKb)

3.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F835-0482 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with F835-0482 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F835-0482?
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What is the minimum amount of F835-0482 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F835-0482
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F835-0482
  • 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 F835-0482 available by request