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

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

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

CAS No:
848217-14-1
Formula:
C25H31N3OS2
Chemical Name:
3-(4-benzylpiperidin-1-yl)-5-ethylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraene
Synonyms:
ZINC2424368;STL160111;AKOS005760104;MCULE-1988752566;4-(4-benzylpiperidin-1-yl)-2-(ethylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;848217-14-1

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

Molecular Weight：

453.7 g/mol

Exact Mass：

453.19085497 g/mol

Characteristics

PSA：

91.8 Å²

Computed Properties

Molecular Weight:453.7
XLogP3:6.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:453.19085497
Monoisotopic Mass:453.19085497
Topological Polar Surface Area:91.8
Heavy Atom Count:31
Complexity:591
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(4-benzylpiperidin-1-yl)-5-ethylsulfanyl-12,12-dimethyl-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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