S606-1120 Screening compound: 1-(2-methoxyethyl)-3-{(3R)-1-[2-(2-methylphenyl)acetyl]tetrahydro-1H-pyrrol-3-yl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

S606-1120 Screening compound: 1-(2-methoxyethyl)-3-{(3R)-1-[2-(2-methylphenyl)acetyl]tetrahydro-1H-pyrrol-3-yl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one
S606-1120 Screening compound: 1-(2-methoxyethyl)-3-{(3R)-1-[2-(2-methylphenyl)acetyl]tetrahydro-1H-pyrrol-3-yl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S606-1120
1-(2-methoxyethyl)-3-{(3R)-1-[2-(2-methylphenyl)acetyl]tetrahydro-1H-pyrrol-3-yl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-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

S606-1120

Molecular Formula

C22H26N4O3 (C22 H26 N4 O3)

Compound Name

1-(2-methoxyethyl)-3-{(3R)-1-[2-(2-methylphenyl)acetyl]tetrahydro-1H-pyrrol-3-yl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

IUPAC name

1-(2-methoxyethyl)-3-[(3R)-1-[2-(2-methylphenyl)acetyl]pyrrolidin-3-yl]-1H2H3H-imidazo[45-b]pyridin-2-one

SMILES

Cc1c(CC(N(CC2)C[C@@H]2N(c(nccc2)c2N2CCOC)C2=O)=O)cccc1

InChI

InChI=1S/C22H26N4O3/c1-16-6-3-4-7-17(16)14-20(27)24-11-9-18(15-24)26-21-19(8-5-10-23-21)25(22(26)28)12-13-29-2/h3-8,10,18H,9,11-15H2,1-2H3/t18-/m1/s1

InChI Key

PUVMBPMWHUZVAR-GOSISDBHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.790

Distribution Coefficient, logD

2.790

Water Solubility, LogSw

-2.83

Polar Surface Area

52.222

Acid Dissociation Constant (pKa)

17.84

Base Dissociation Constant (pKb)

1.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.91

S606-1120 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 S606-1120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S606-1120?
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What is the minimum amount of S606-1120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S606-1120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S606-1120
  • 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 S606-1120 available by request