ZC43-0018 Screening compound: 1-[4-(5-isobutyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)piperidino]-2-phenoxy-1-ethanone

ZC43-0018 Screening compound: 1-[4-(5-isobutyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)piperidino]-2-phenoxy-1-ethanone
ZC43-0018 Screening compound: 1-[4-(5-isobutyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)piperidino]-2-phenoxy-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound ZC43-0018
1-[4-(5-isobutyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)piperidino]-2-phenoxy-1-ethanone

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

ZC43-0018

Molecular Formula

C23H32N4O2 (C23 H32 N4 O2)

Compound Name

1-[4-(5-isobutyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-4-yl)piperidino]-2-phenoxy-1-ethanone

IUPAC name

1-{4-[5-(2-methylpropyl)-3H4H5H6H7H-imidazo[45-c]pyridin-4-yl]piperidin-1-yl}-2-phenoxyethan-1-one

SMILES

CC(C)CN(CC1)C(C(CC2)CCN2C(COc2ccccc2)=O)c2c1nc[nH]2

InChI

InChI=1S/C23H32N4O2/c1-17(2)14-27-13-10-20-22(25-16-24-20)23(27)18-8-11-26(12-9-18)21(28)15-29-19-6-4-3-5-7-19/h3-7,16-18,23H,8-15H2,1-2H3,(H,24,25)/t23-/m0/s1

InChI Key

RMYBABXJXOMUKH-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD31957272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.606

Distribution Coefficient, logD

1.163

Water Solubility, LogSw

-2.77

Polar Surface Area

50.193

Acid Dissociation Constant (pKa)

14.25

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.52

ZC43-0018 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with ZC43-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound ZC43-0018?
Check Price and Availability of ZC43-0018, 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 ZC43-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for ZC43-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for ZC43-0018
  • 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 ZC43-0018 available by request