P033-1027 Screening compound: N-{[4-(propan-2-yl)phenyl]methyl}-6-(3,4,5-trimethyl-1H-pyrazol-1-yl)pyridine-3-carboxamide

P033-1027 Screening compound: N-{[4-(propan-2-yl)phenyl]methyl}-6-(3,4,5-trimethyl-1H-pyrazol-1-yl)pyridine-3-carboxamide
P033-1027 Screening compound: N-{[4-(propan-2-yl)phenyl]methyl}-6-(3,4,5-trimethyl-1H-pyrazol-1-yl)pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P033-1027
N-{[4-(propan-2-yl)phenyl]methyl}-6-(3,4,5-trimethyl-1H-pyrazol-1-yl)pyridine-3-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

P033-1027

Molecular Formula

C22H26N4O (C22 H26 N4 O)

Compound Name

N-{[4-(propan-2-yl)phenyl]methyl}-6-(3,4,5-trimethyl-1H-pyrazol-1-yl)pyridine-3-carboxamide

IUPAC name

N-{[4-(propan-2-yl)phenyl]methyl}-6-(345-trimethyl-1H-pyrazol-1-yl)pyridine-3-carboxamide

SMILES

CC(C)c1ccc(CNC(c(cc2)cnc2-n2nc(C)c(C)c2C)=O)cc1

InChI

InChI=1S/C22H26N4O/c1-14(2)19-8-6-18(7-9-19)12-24-22(27)20-10-11-21(23-13-20)26-17(5)15(3)16(4)25-26/h6-11,13-14H,12H2,1-5H3,(H,24,27)

InChI Key

ZIARDNWBBWJTBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22598564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.234

Distribution Coefficient, logD

4.224

Water Solubility, LogSw

-4.08

Polar Surface Area

47.671

Acid Dissociation Constant (pKa)

11.16

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

P033-1027 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with P033-1027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P033-1027?
Check Price and Availability of P033-1027, 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 P033-1027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P033-1027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P033-1027
  • 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 P033-1027 available by request