F305-0680 Screening compound: 1-[6-(3-methylphenyl)pyridazin-3-yl]-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide

F305-0680 Screening compound: 1-[6-(3-methylphenyl)pyridazin-3-yl]-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide
F305-0680 Screening compound: 1-[6-(3-methylphenyl)pyridazin-3-yl]-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F305-0680
1-[6-(3-methylphenyl)pyridazin-3-yl]-N-[(4-propoxyphenyl)methyl]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

F305-0680

Molecular Formula

C27H32N4O2 (C27 H32 N4 O2)

Compound Name

1-[6-(3-methylphenyl)pyridazin-3-yl]-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide

IUPAC name

1-[6-(3-methylphenyl)pyridazin-3-yl]-N-[(4-propoxyphenyl)methyl]piperidine-4-carboxamide

SMILES

CCCOc1ccc(CNC(C(CC2)CCN2c(cc2)nnc2-c2cc(C)ccc2)=O)cc1

InChI

InChI=1S/C27H32N4O2/c1-3-17-33-24-9-7-21(8-10-24)19-28-27(32)22-13-15-31(16-14-22)26-12-11-25(29-30-26)23-6-4-5-20(2)18-23/h4-12,18,22H,3,13-17,19H2,1-2H3,(H,28,32)

InChI Key

WANYYCKGDDQRHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27114439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.826

Distribution Coefficient, logD

4.820

Water Solubility, LogSw

-4.55

Polar Surface Area

56.457

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

F305-0680 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with F305-0680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F305-0680?
Check Price and Availability of F305-0680, 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 F305-0680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F305-0680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F305-0680
  • 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 F305-0680 available by request