 Home > Encyclopedia > [1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

[1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

[1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride structure

CAS No:
38952-80-6
Formula:
C29H40ClN3O10
Chemical Name:
[1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride
Synonyms:
Benzoic acid,3,4,5-trimethoxy-,1-(((3-methoxypropyl)methylamino)methyl)-2-(5,6,7-trimethoxy-1-oxo-2(1H)-phthalazinyl)ethyl ester,monohydrochloride; [1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate hydrochloride; 1-[(3-methoxypropyl)(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2(1H)-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride (1:1);

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[1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride Basic Attributes

Molecular Weight：

626.09500

Exact Mass：

625.2402222 g/mol

Characteristics

PSA：

129.04000

XLogP3：

3.44400

Boiling Point：

683.2ºC

Flash Point：

367ºC

Computed Properties

Molecular Weight:626.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:17
Exact Mass:625.2402222
Monoisotopic Mass:625.2402222
Topological Polar Surface Area:127
Heavy Atom Count:43
Complexity:865
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of [1-[3-methoxypropyl(methyl)amino]-3-(5,6,7-trimethoxy-1-oxophthalazin-2-yl)propan-2-yl] 3,4,5-trimethoxybenzoate,hydrochloride

Basic Attributes
Characteristics
Computed Properties
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