S607-0395 Screening compound: 3-[1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]-1-(2-methoxyethyl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one

S607-0395 Screening compound: 3-[1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]-1-(2-methoxyethyl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one
S607-0395 Screening compound: 3-[1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]-1-(2-methoxyethyl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S607-0395
3-[1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]-1-(2-methoxyethyl)-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

S607-0395

Molecular Formula

C20H26N4O3 (C20 H26 N4 O3)

Compound Name

3-[1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]-1-(2-methoxyethyl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one

IUPAC name

3-[(3S)-1-(cyclopent-3-ene-1-carbonyl)piperidin-3-yl]-1-(2-methoxyethyl)-1H2H3H-imidazo[45-b]pyridin-2-one

SMILES

COCCN(c1c(N2[C@@H](CCC3)CN3C(C3CC=CC3)=O)nccc1)C2=O

InChI

InChI=1S/C20H26N4O3/c1-27-13-12-23-17-9-4-10-21-18(17)24(20(23)26)16-8-5-11-22(14-16)19(25)15-6-2-3-7-15/h2-4,9-10,15-16H,5-8,11-14H2,1H3/t16-/m0/s1

InChI Key

LFBCHSYGKFJURY-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.805

Distribution Coefficient, logD

1.805

Water Solubility, LogSw

-1.78

Polar Surface Area

52.941

Acid Dissociation Constant (pKa)

21.92

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.00

S607-0395 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S607-0395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S607-0395?
Check Price and Availability of S607-0395, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S607-0395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S607-0395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S607-0395
  • 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 S607-0395 available by request