6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]pyrimidine-2,4-dione
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![6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]pyrimidine-2,4-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e55a99dd0f4e4bad90c9e60517ceb694.png "6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]pyrimidine-2,4-dione")
6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]pyrimidine-2,4-dione
structure -
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CAS No:
745788-96-9
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Formula:
C20H23N5O3S2
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Chemical Name:
6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]pyrimidine-2,4-dione
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Synonyms:
ZINC2630171;AKOS033737177;MCULE-8983076818;Z20228031;6-amino-3-methyl-1-(2-methylpropyl)-5-(2-{7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraen-12-ylsulfanyl}acetyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione;745788-96-9
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CAS No:
6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]pyrimidine-2,4-dione Basic Attributes
445.6 g/mol
445.12423196 g/mol
Computed Properties
Molecular Weight:445.6
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:445.12423196
Monoisotopic Mass:445.12423196
Topological Polar Surface Area:163
Heavy Atom Count:30
Complexity:774
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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