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

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

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

CAS No:
799806-68-1
Formula:
C24H21FN2O2S2
Chemical Name:
5-[(3-fluorophenyl)methylsulfanyl]-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
ZINC2225641;STK548925;AKOS005476729;MCULE-1032303620;2-((3-fluorobenzyl)thio)-6,6-dimethyl-3-phenyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one;2-[(3-fluorobenzyl)sulfanyl]-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;799806-68-1

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

Molecular Weight：

452.6 g/mol

Exact Mass：

452.10284843 g/mol

Characteristics

PSA：

95.4 Å²

Computed Properties

Molecular Weight:452.6
XLogP3:5.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:452.10284843
Monoisotopic Mass:452.10284843
Topological Polar Surface Area:95.4
Heavy Atom Count:31
Complexity:712
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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