5-(3-hydroxypropylamino)-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
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![5-(3-hydroxypropylamino)-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](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6d95b34286544a0da7b82fa5637ac40f.png "5-(3-hydroxypropylamino)-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-(3-hydroxypropylamino)-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
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CAS No:
328034-70-4
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Formula:
C18H14N6O3
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Chemical Name:
5-(3-hydroxypropylamino)-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
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Synonyms:
MLS000391903;SMR000260936;CHEMBL1465122;BDBM96446;cid_2318621;HMS2640A10;AKOS034454605;ZINC100614076;MCULE-8965334273;AB00709517-01;Z56786075;2-[(3-hydroxypropyl)amino]-6,13-dioxo-11,13-dihydro-6H-1,3,5a,11-tetraazatetraphene-12-carbonitrile;3-[(3-Hydroxypropyl)amino]-5,12-dioxo-7,12-dihydro-5H-2,4,7,12a-tetraazabenzo[a]anthracene-6-carbonitrile;328034-70-4
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CAS No:
5-(3-hydroxypropylamino)-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
362.3 g/mol
362.11273833 g/mol
Computed Properties
Molecular Weight:362.3
XLogP3:1.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:362.11273833
Monoisotopic Mass:362.11273833
Topological Polar Surface Area:131
Heavy Atom Count:27
Complexity:713
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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