F428-0676 Screening compound: N-{3-[3,4-dihydro-2(1H)-isoquinolinyl]propyl}-1-(6-piperidino-3-pyridazinyl)-4-piperidinecarboxamide

F428-0676 Screening compound: N-{3-[3,4-dihydro-2(1H)-isoquinolinyl]propyl}-1-(6-piperidino-3-pyridazinyl)-4-piperidinecarboxamide
F428-0676 Screening compound: N-{3-[3,4-dihydro-2(1H)-isoquinolinyl]propyl}-1-(6-piperidino-3-pyridazinyl)-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F428-0676
N-{3-[3,4-dihydro-2(1H)-isoquinolinyl]propyl}-1-(6-piperidino-3-pyridazinyl)-4-piperidinecarboxamide

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

F428-0676

Molecular Formula

C27H38N6O (C27 H38 N6 O)

Compound Name

N-{3-[3,4-dihydro-2(1H)-isoquinolinyl]propyl}-1-(6-piperidino-3-pyridazinyl)-4-piperidinecarboxamide

IUPAC name

1-[6-(piperidin-1-yl)pyridazin-3-yl]-N-[3-(1234-tetrahydroisoquinolin-2-yl)propyl]piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1c(cc1)nnc1N1CCCCC1)NCCCN(CC1)Cc2c1cccc2

InChI

InChI=1S/C27H38N6O/c34-27(28-14-6-15-31-18-11-22-7-2-3-8-24(22)21-31)23-12-19-33(20-13-23)26-10-9-25(29-30-26)32-16-4-1-5-17-32/h2-3,7-10,23H,1,4-6,11-21H2,(H,28,34)

InChI Key

OHCAEQNSZIVOAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27127550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.64

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.728

Distribution Coefficient, logD

2.524

Water Solubility, LogSw

-3.77

Polar Surface Area

55.713

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

8.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.26

References: we are preparing a list of scientific research reports with F428-0676 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F428-0676?
Check Price and Availability of F428-0676, 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 F428-0676 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F428-0676
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F428-0676
  • 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 F428-0676 available by request