F814-1121 Screening compound: N-[(4-chlorophenyl)methyl]-2-[(6-{[(4-methylphenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide

F814-1121 Screening compound: N-[(4-chlorophenyl)methyl]-2-[(6-{[(4-methylphenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide
F814-1121 Screening compound: N-[(4-chlorophenyl)methyl]-2-[(6-{[(4-methylphenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F814-1121
N-[(4-chlorophenyl)methyl]-2-[(6-{[(4-methylphenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide

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

F814-1121

Molecular Formula

C21H21ClN4OS (C21 H21 ClN4 OS)

Compound Name

N-[(4-chlorophenyl)methyl]-2-[(6-{[(4-methylphenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide

IUPAC name

N-[(4-chlorophenyl)methyl]-2-[(6-{[(4-methylphenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide

SMILES

Cc1ccc(CNc(cc2)nnc2SCC(NCc(cc2)ccc2Cl)=O)cc1

InChI

InChI=1S/C21H21ClN4OS/c1-15-2-4-16(5-3-15)12-23-19-10-11-21(26-25-19)28-14-20(27)24-13-17-6-8-18(22)9-7-17/h2-11H,12-14H2,1H3,(H,23,25)(H,24,27)

InChI Key

XHUHXRFPIAOYSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27193955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.94

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.061

Distribution Coefficient, logD

4.061

Water Solubility, LogSw

-4.35

Polar Surface Area

56.344

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

F814-1121 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F814-1121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F814-1121?
Check Price and Availability of F814-1121, 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 F814-1121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F814-1121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F814-1121
  • 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 F814-1121 available by request