S607-0528 Screening compound: 1-benzyl-3-(1-propanoylpiperidin-3-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one

S607-0528 Screening compound: 1-benzyl-3-(1-propanoylpiperidin-3-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one
S607-0528 Screening compound: 1-benzyl-3-(1-propanoylpiperidin-3-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S607-0528
1-benzyl-3-(1-propanoylpiperidin-3-yl)-1H,2H,3H-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

S607-0528

Molecular Formula

C21H24N4O2 (C21 H24 N4 O2)

Compound Name

1-benzyl-3-(1-propanoylpiperidin-3-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one

IUPAC name

1-benzyl-3-[(3S)-1-propanoylpiperidin-3-yl]-1H2H3H-imidazo[45-b]pyridin-2-one

SMILES

CCC(N(CCC1)C[C@H]1N(c(nccc1)c1N1Cc2ccccc2)C1=O)=O

InChI

InChI=1S/C21H24N4O2/c1-2-19(26)23-13-7-10-17(15-23)25-20-18(11-6-12-22-20)24(21(25)27)14-16-8-4-3-5-9-16/h3-6,8-9,11-12,17H,2,7,10,13-15H2,1H3/t17-/m0/s1

InChI Key

JHPVECBURSPWFD-KRWDZBQOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.953

Distribution Coefficient, logD

2.953

Water Solubility, LogSw

-3.11

Polar Surface Area

43.535

Acid Dissociation Constant (pKa)

21.92

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

S607-0528 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 S607-0528 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S607-0528?
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What is the minimum amount of S607-0528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S607-0528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S607-0528
  • 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 S607-0528 available by request