P859-0040 Screening compound: 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-[4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carboxamide

P859-0040 Screening compound: 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-[4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carboxamide
P859-0040 Screening compound: 2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-[4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P859-0040
2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-[4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carboxamide

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

P859-0040

Molecular Formula

C22H31N5O2 (C22 H31 N5 O2)

Compound Name

2,5-dimethyl-1-(1-methylpiperidin-4-yl)-N-[4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carboxamide

IUPAC name

25-dimethyl-1-(1-methylpiperidin-4-yl)-N-[4-(morpholin-4-yl)phenyl]-1H-imidazole-4-carboxamide

SMILES

Cc1c(C(Nc(cc2)ccc2N2CCOCC2)=O)nc(C)n1C1CCN(C)CC1

InChI

InChI=1S/C22H31N5O2/c1-16-21(23-17(2)27(16)20-8-10-25(3)11-9-20)22(28)24-18-4-6-19(7-5-18)26-12-14-29-15-13-26/h4-7,20H,8-15H2,1-3H3,(H,24,28)

InChI Key

WKUUDHMFHXRPFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29025946

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.859

Distribution Coefficient, logD

-0.559

Water Solubility, LogSw

-2.39

Polar Surface Area

50.730

Acid Dissociation Constant (pKa)

11.49

Base Dissociation Constant (pKb)

9.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

P859-0040 in Drug Discovery

Included in Screening Libraries

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

Bromodomain Modulators Library (5801 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Akt-Targeted Library (14764 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P859-0040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P859-0040?
Check Price and Availability of P859-0040, 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 P859-0040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P859-0040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P859-0040
  • 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 P859-0040 available by request