N-benzyl-2-[(5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetamide
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N-benzyl-2-[(5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetamide
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CAS No:
585556-84-9
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Formula:
C27H27N3O2S3
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Chemical Name:
N-benzyl-2-[(5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetamide
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Synonyms:
ZINC2391994;STK558111;AKOS005483850;MCULE-4059474111;585556-84-9;N-benzyl-2-{[2-(benzylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
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CAS No:
N-benzyl-2-[(5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetamide Basic Attributes
521.7 g/mol
521.12654063 g/mol
Computed Properties
Molecular Weight:521.7
XLogP3:5.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:521.12654063
Monoisotopic Mass:521.12654063
Topological Polar Surface Area:143
Heavy Atom Count:35
Complexity:699
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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