N-benzyl-5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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N-benzyl-5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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CAS No:
578732-69-1
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Formula:
C25H25N3OS2
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Chemical Name:
N-benzyl-5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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Synonyms:
ZINC2394484;STK558328;AKOS005484148;MCULE-4631880175;578732-69-1;N-benzyl-2-(benzylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
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CAS No:
N-benzyl-5-benzylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine Basic Attributes
447.6 g/mol
447.14390478 g/mol
Computed Properties
Molecular Weight:447.6
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:447.14390478
Monoisotopic Mass:447.14390478
Topological Polar Surface Area:101
Heavy Atom Count:31
Complexity:579
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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