S022-1420 Screening compound: 2-(2-chlorophenyl)-7-[2-(3-methylphenyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one

S022-1420 Screening compound: 2-(2-chlorophenyl)-7-[2-(3-methylphenyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
S022-1420 Screening compound: 2-(2-chlorophenyl)-7-[2-(3-methylphenyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S022-1420
2-(2-chlorophenyl)-7-[2-(3-methylphenyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-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

S022-1420

Molecular Formula

C24H21ClN4O2 (C24 H21 ClN4 O2)

Compound Name

2-(2-chlorophenyl)-7-[2-(3-methylphenyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one

IUPAC name

5-(2-chlorophenyl)-11-[2-(3-methylphenyl)acetyl]-26711-tetraazatricyclo[7.4.0.0^{37}]trideca-1(9)24-trien-8-one

SMILES

Cc1cccc(CC(N(CC2)CC(C3=O)=C2N=C2N3NC(c(cccc3)c3Cl)=C2)=O)c1

InChI

InChI=1S/C24H21ClN4O2/c1-15-5-4-6-16(11-15)12-23(30)28-10-9-20-18(14-28)24(31)29-22(26-20)13-21(27-29)17-7-2-3-8-19(17)25/h2-8,11,13,27H,9-10,12,14H2,1H3

InChI Key

WFGSQTVMAFSWFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29020197

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.91

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.655

Distribution Coefficient, logD

3.653

Water Solubility, LogSw

-3.95

Polar Surface Area

56.266

Acid Dissociation Constant (pKa)

8.09

Base Dissociation Constant (pKb)

0.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

S022-1420 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S022-1420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S022-1420?
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What is the minimum amount of S022-1420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S022-1420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S022-1420
  • 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 S022-1420 available by request