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Home > Encyclopedia > [1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

[1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

[1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride structure

[1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride 

structure
  • CAS No:

    37046-98-3

  • Formula:

    C28H36ClN3O9S

  • Chemical Name:

    [1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

  • Synonyms:

    Benzoic acid,3,4,5-trimethoxy-,1-((1,4-dihydro-6,7,8-trimethoxy-4-oxo-2-thioxo-3(2H)-quinazolinyl)methyl)-2-(methyl(2-propenyl)amino)ethyl ester,hydrochloride; [1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate hydrochloride;

[1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride Basic Attributes

626.11800

625.1860786

Characteristics

158.61000

3.88220

668.9ºC

358.4ºC

Computed Properties

Molecular Weight:626.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:15
Exact Mass:625.1860786
Monoisotopic Mass:625.1860786
Topological Polar Surface Area:149
Heavy Atom Count:42
Complexity:897
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Guide of [1-[methyl(prop-2-enyl)amino]-3-(6,7,8-trimethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

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