 Home > Encyclopedia > 3-benzylsulfanyl-12,12-dimethyl-5-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

3-benzylsulfanyl-12,12-dimethyl-5-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

3-benzylsulfanyl-12,12-dimethyl-5-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene structure

CAS No:
497241-04-0
Formula:
C24H22N2OS2
Chemical Name:
3-benzylsulfanyl-12,12-dimethyl-5-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene
Synonyms:
ZINC2334533;STK547774;AKOS005476015;MCULE-2103004327;4-(benzylsulfanyl)-6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;497241-04-0

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3-benzylsulfanyl-12,12-dimethyl-5-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene Basic Attributes

Molecular Weight：

418.6 g/mol

Exact Mass：

418.11735568 g/mol

Characteristics

PSA：

88.6 Å²

Computed Properties

Molecular Weight:418.6
XLogP3:5.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:418.11735568
Monoisotopic Mass:418.11735568
Topological Polar Surface Area:88.6
Heavy Atom Count:29
Complexity:547
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-benzylsulfanyl-12,12-dimethyl-5-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

Basic Attributes
Characteristics
Computed Properties

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