F946-0219 Screening compound: methyl 4-{5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methylbenzenesulfonamido}benzoate

F946-0219 Screening compound: methyl 4-{5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methylbenzenesulfonamido}benzoate
F946-0219 Screening compound: methyl 4-{5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methylbenzenesulfonamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F946-0219
methyl 4-{5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methylbenzenesulfonamido}benzoate

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

F946-0219

Molecular Formula

C24H22N4O6S (C24 H22 N4 O6 S)

Compound Name

methyl 4-{5-[1-(3,5-dimethyl-1,2-oxazol-4-yl)-6-oxo-1,6-dihydropyridazin-3-yl]-2-methylbenzenesulfonamido}benzoate

IUPAC name

methyl 4-{5-[1-(35-dimethyl-12-oxazol-4-yl)-6-oxo-16-dihydropyridazin-3-yl]-2-methylbenzenesulfonamido}benzoate

SMILES

Cc1noc(C)c1N(C(C=C1)=O)N=C1c1cc(S(Nc(cc2)ccc2C(OC)=O)(=O)=O)c(C)cc1

InChI

InChI=1S/C24H22N4O6S/c1-14-5-6-18(20-11-12-22(29)28(25-20)23-15(2)26-34-16(23)3)13-21(14)35(31,32)27-19-9-7-17(8-10-19)24(30)33-4/h5-13,27H,1-4H3

InChI Key

YTXCJKSTMVGFTM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27205504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.53

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.767

Distribution Coefficient, logD

2.741

Water Solubility, LogSw

-4.23

Polar Surface Area

110.388

Acid Dissociation Constant (pKa)

6.42

Base Dissociation Constant (pKb)

1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

F946-0219 in Drug Discovery

Included in Screening Libraries

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

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 F946-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F946-0219?
Check Price and Availability of F946-0219, 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 F946-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F946-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F946-0219
  • 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 F946-0219 available by request