5-[2-(3,4-dimethoxyphenyl)ethylamino]-15-methyl-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12(17),13,15-heptaene-9-carbonitrile
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![5-[2-(3,4-dimethoxyphenyl)ethylamino]-15-methyl-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12(17),13,15-heptaene-9-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9ae5a4afe35f4a779d8a0f86708a348e.png "5-[2-(3,4-dimethoxyphenyl)ethylamino]-15-methyl-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12(17),13,15-heptaene-9-carbonitrile")
5-[2-(3,4-dimethoxyphenyl)ethylamino]-15-methyl-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12(17),13,15-heptaene-9-carbonitrile
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CAS No:
328037-02-1
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Formula:
C26H22N6O4
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Chemical Name:
5-[2-(3,4-dimethoxyphenyl)ethylamino]-15-methyl-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12(17),13,15-heptaene-9-carbonitrile
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Synonyms:
Oprea1_609142;AKOS034454642;MCULE-7588749031;Z56786291;2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-8-methyl-6,13-dioxo-11,13-dihydro-6H-1,3,5a,11-tetraazatetraphene-12-carbonitrile;3-[(3,4-Dimethoxyphenethyl)amino]-5,12-dioxo-10-methyl-7,12-dihydro-5H-2,4,7,12a-tetraazabenzo[a]anthracene-6-carbonitrile;328037-02-1
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CAS No:
5-[2-(3,4-dimethoxyphenyl)ethylamino]-15-methyl-8,18-dioxo-1,4,6,11-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,9,12(17),13,15-heptaene-9-carbonitrile Basic Attributes
482.5 g/mol
482.17025320 g/mol
Computed Properties
Molecular Weight:482.5
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:482.17025320
Monoisotopic Mass:482.17025320
Topological Polar Surface Area:130
Heavy Atom Count:36
Complexity:946
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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