M621-0434 Screening compound: 1-methyl-4-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}piperazine

M621-0434 Screening compound: 1-methyl-4-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}piperazine
M621-0434 Screening compound: 1-methyl-4-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M621-0434
1-methyl-4-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}piperazine

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

M621-0434

Molecular Formula

C21H25N5O (C21 H25 N5 O)

Compound Name

1-methyl-4-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}piperazine

IUPAC name

1-methyl-4-{3-[3-(propan-2-yl)-3H-imidazo[45-b]pyridin-2-yl]benzoyl}piperazine

SMILES

CC(C)n1c(-c2cccc(C(N3CCN(C)CC3)=O)c2)nc2c1nccc2

InChI

InChI=1S/C21H25N5O/c1-15(2)26-19(23-18-8-5-9-22-20(18)26)16-6-4-7-17(14-16)21(27)25-12-10-24(3)11-13-25/h4-9,14-15H,10-13H2,1-3H3

InChI Key

FYGBSKXMQNWHDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27549313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.243

Distribution Coefficient, logD

2.112

Water Solubility, LogSw

-2.56

Polar Surface Area

41.274

Acid Dissociation Constant (pKa)

17.07

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

M621-0434 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

Cardiovascular Library (22201 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with M621-0434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M621-0434?
Check Price and Availability of M621-0434, 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 M621-0434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M621-0434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M621-0434
  • 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 M621-0434 available by request