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

2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-1-phenylethanone

2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-1-phenylethanone structure

CAS No:
488102-82-5
Formula:
C21H22N2O2S2
Chemical Name:
2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-1-phenylethanone
Synonyms:
ZINC2328227;STK547903;AKOS005476000;MCULE-6762164468;2-[(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone;488102-82-5

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2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-1-phenylethanone Basic Attributes

Molecular Weight：

398.5 g/mol

Exact Mass：

398.11227030 g/mol

Characteristics

PSA：

106 Å²

Computed Properties

Molecular Weight:398.5
XLogP3:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:398.11227030
Monoisotopic Mass:398.11227030
Topological Polar Surface Area:106
Heavy Atom Count:27
Complexity:538
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-1-phenylethanone

Basic Attributes
Characteristics
Computed Properties

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