 Home > Encyclopedia > 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-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-(1,3-benzodioxol-5-ylmethylsulfanyl)-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-(1,3-benzodioxol-5-ylmethylsulfanyl)-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:
488089-72-1
Formula:
C25H22N2O3S2
Chemical Name:
3-(1,3-benzodioxol-5-ylmethylsulfanyl)-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:
ZINC2325518;STK547741;AKOS005475678;MCULE-9176993508;4-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;488089-72-1

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3-(1,3-benzodioxol-5-ylmethylsulfanyl)-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：

462.6 g/mol

Exact Mass：

462.10718492 g/mol

Characteristics

PSA：

107 Å²

Computed Properties

Molecular Weight:462.6
XLogP3:5.7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:462.10718492
Monoisotopic Mass:462.10718492
Topological Polar Surface Area:107
Heavy Atom Count:32
Complexity:661
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(1,3-benzodioxol-5-ylmethylsulfanyl)-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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