 Home > Encyclopedia > 5-[2-(3,4-dimethoxyphenyl)ethylamino]-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12,14,16-heptaene-9-carbonitrile

5-[2-(3,4-dimethoxyphenyl)ethylamino]-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12,14,16-heptaene-9-carbonitrile

5-[2-(3,4-dimethoxyphenyl)ethylamino]-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12,14,16-heptaene-9-carbonitrile structure

CAS No:
328033-69-8
Formula:
C25H20N6O4
Chemical Name:
5-[2-(3,4-dimethoxyphenyl)ethylamino]-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12,14,16-heptaene-9-carbonitrile
Synonyms:
Oprea1_441634;HMS1726C20;ZINC3186805;AKOS034454593;MCULE-4255467988;Z56786003;2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-6,13-dioxo-11,13-dihydro-6H-1,3,5a,11-tetraazatetraphene-12-carbonitrile;328033-69-8

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5-[2-(3,4-dimethoxyphenyl)ethylamino]-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12,14,16-heptaene-9-carbonitrile Basic Attributes

Molecular Weight：

468.5 g/mol

Exact Mass：

468.15460314 g/mol

Characteristics

PSA：

130 Å²

Computed Properties

Molecular Weight:468.5
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:468.15460314
Monoisotopic Mass:468.15460314
Topological Polar Surface Area:130
Heavy Atom Count:35
Complexity:915
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[2-(3,4-dimethoxyphenyl)ethylamino]-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12,14,16-heptaene-9-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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