CM3124-1044 Screening compound: 6-methyl-N~3~-[1-(1-methyl-6-oxo-1,6-dihydro-3-pyridazinyl)-4-piperidyl]nicotinamide

CM3124-1044 Screening compound: 6-methyl-N~3~-[1-(1-methyl-6-oxo-1,6-dihydro-3-pyridazinyl)-4-piperidyl]nicotinamide
CM3124-1044 Screening compound: 6-methyl-N~3~-[1-(1-methyl-6-oxo-1,6-dihydro-3-pyridazinyl)-4-piperidyl]nicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound CM3124-1044
6-methyl-N~3~-[1-(1-methyl-6-oxo-1,6-dihydro-3-pyridazinyl)-4-piperidyl]nicotinamide

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

CM3124-1044

Molecular Formula

C17H21N5O2 (C17 H21 N5 O2)

Compound Name

6-methyl-N~3~-[1-(1-methyl-6-oxo-1,6-dihydro-3-pyridazinyl)-4-piperidyl]nicotinamide

IUPAC name

6-methyl-N-[1-(1-methyl-6-oxo-16-dihydropyridazin-3-yl)piperidin-4-yl]pyridine-3-carboxamide

SMILES

Cc(cc1)ncc1C(NC(CC1)CCN1C(C=C1)=NN(C)C1=O)=O

InChI

InChI=1S/C17H21N5O2/c1-12-3-4-13(11-18-12)17(24)19-14-7-9-22(10-8-14)15-5-6-16(23)21(2)20-15/h3-6,11,14H,7-10H2,1-2H3,(H,19,24)

InChI Key

QPDGKCIFFXNTQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30459620

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.675

Distribution Coefficient, logD

0.675

Water Solubility, LogSw

-1.45

Polar Surface Area

64.965

Acid Dissociation Constant (pKa)

14.39

Base Dissociation Constant (pKb)

3.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

CM3124-1044 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with CM3124-1044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM3124-1044?
Check Price and Availability of CM3124-1044, 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 CM3124-1044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM3124-1044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM3124-1044
  • 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 CM3124-1044 available by request