F833-0658 Screening compound: 9-(4-chlorophenyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one

F833-0658 Screening compound: 9-(4-chlorophenyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one
F833-0658 Screening compound: 9-(4-chlorophenyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F833-0658
9-(4-chlorophenyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-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

F833-0658

Molecular Formula

C19H17ClN6O2 (C19 H17 ClN6 O2)

Compound Name

9-(4-chlorophenyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one

IUPAC name

11-(4-chlorophenyl)-4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)2710-tetraen-5-one

SMILES

O=C(CN1N=C(c2cc(-c(cc3)ccc3Cl)nn2C=C2)N2C1=O)N1CCCC1

InChI

InChI=1S/C19H17ClN6O2/c20-14-5-3-13(4-6-14)15-11-16-18-22-26(12-17(27)23-7-1-2-8-23)19(28)24(18)9-10-25(16)21-15/h3-6,9-11H,1-2,7-8,12H2

InChI Key

ZOLGXSRHHWSQGD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.84

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.104

Distribution Coefficient, logD

2.104

Water Solubility, LogSw

-3.05

Polar Surface Area

60.078

Acid Dissociation Constant (pKa)

18.79

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

F833-0658 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F833-0658 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F833-0658?
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What is the minimum amount of F833-0658 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F833-0658
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F833-0658
  • 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 F833-0658 available by request