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

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

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

CAS No:
578733-95-6
Formula:
C22H25N3OS2
Chemical Name:
5-benzylsulfanyl-12,12-dimethyl-3-pyrrolidin-1-yl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraene
Synonyms:
ZINC2394507;STK829847;AKOS001491805;MCULE-1364386791;2-(benzylsulfanyl)-6,6-dimethyl-4-(pyrrolidin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;2-(benzylthio)-6,6-dimethyl-4-pyrrolidin-1-yl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;578733-95-6

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

Molecular Weight：

411.6 g/mol

Exact Mass：

411.14390478 g/mol

Characteristics

PSA：

91.8 Å²

Computed Properties

Molecular Weight:411.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:411.14390478
Monoisotopic Mass:411.14390478
Topological Polar Surface Area:91.8
Heavy Atom Count:28
Complexity:536
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: dinitrogen tetroxide; poly methyl acrylate; phenol red; borane; zafirlukast; sulfur trioxide formula

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

Basic Attributes
Characteristics
Computed Properties

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