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Zopolrestat

Zopolrestat structure

Zopolrestat 

structure
  • CAS No:

    110703-94-1

  • Formula:

    C19H12F3N3O3S

  • Chemical Name:

    Zopolrestat

  • Synonyms:

    2-[4-oxo-3-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]phthalazin-1-yl]acetic acid;

Zopolrestat Basic Attributes

419.37700

419.05514691 g/mol

1PV3S9WP3D

DTXSID80149365

Characteristics

113.32000

3.70040

1.58g/cm3

598.7ºC at 760mmHg

315.9ºC

1.683

3.5E-15mmHg at 25°C

Safety Information

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P273, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)|Substances which lower blood glucose levels. (See all compounds classified as Hypoglycemic Agents.)

3,4-dihydro-4-oxo-3-((5-(trifluoromethyl)-2-benzothiazolyl)methyl)-1-phthalazine-acetic acid

Computed Properties

Molecular Weight:419.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:419.05514691
Monoisotopic Mass:419.05514691
Topological Polar Surface Area:111
Heavy Atom Count:29
Complexity:702
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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