G020-0006 Screening compound: 2-ethyl-6-[(4-methylphenyl)methyl]-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one

G020-0006 Screening compound: 2-ethyl-6-[(4-methylphenyl)methyl]-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one
G020-0006 Screening compound: 2-ethyl-6-[(4-methylphenyl)methyl]-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G020-0006
2-ethyl-6-[(4-methylphenyl)methyl]-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-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

G020-0006

Molecular Formula

C21H25N5O2S (C21 H25 N5 O2 S)

Compound Name

2-ethyl-6-[(4-methylphenyl)methyl]-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one

IUPAC name

2-ethyl-6-[(4-methylphenyl)methyl]-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2H6H7H-pyrazolo[43-d]pyrimidin-7-one

SMILES

CCn(cc1N=C(N2Cc3ccc(C)cc3)SCC(N3CCCC3)=O)nc1C2=O

InChI

InChI=1S/C21H25N5O2S/c1-3-25-13-17-19(23-25)20(28)26(12-16-8-6-15(2)7-9-16)21(22-17)29-14-18(27)24-10-4-5-11-24/h6-9,13H,3-5,10-12,14H2,1-2H3

InChI Key

OSSNJTZDFBGFOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14977517

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.622

Distribution Coefficient, logD

2.622

Water Solubility, LogSw

-2.76

Polar Surface Area

57.669

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

G020-0006 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G020-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G020-0006?
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What is the minimum amount of G020-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G020-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G020-0006
  • 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 G020-0006 available by request