F428-0652 Screening compound: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide

F428-0652 Screening compound: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide
F428-0652 Screening compound: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F428-0652
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-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

F428-0652

Molecular Formula

C25H31ClN6O (C25 H31 ClN6 O)

Compound Name

N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide

IUPAC name

N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1c(cc1)nnc1N1CCCCC1)NCCc1c[nH]c(cc2)c1cc2Cl

InChI

InChI=1S/C25H31ClN6O/c26-20-4-5-22-21(16-20)19(17-28-22)8-11-27-25(33)18-9-14-32(15-10-18)24-7-6-23(29-30-24)31-12-2-1-3-13-31/h4-7,16-18,28H,1-3,8-15H2,(H,27,33)

InChI Key

PUWNGPXSQBIPKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27127541

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.432

Distribution Coefficient, logD

4.429

Water Solubility, LogSw

-4.52

Polar Surface Area

61.939

Acid Dissociation Constant (pKa)

13.87

Base Dissociation Constant (pKb)

7.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

F428-0652 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with F428-0652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F428-0652?
Check Price and Availability of F428-0652, 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 F428-0652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F428-0652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F428-0652
  • 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 F428-0652 available by request