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

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

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

CAS No:
308289-69-2
Formula:
C31H28N2O2S2
Chemical Name:
5-benzhydrylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
C31H28N2O2S2;ZINC2271369;STK699005;AKOS005521643;MCULE-4888056159;2-[(diphenylmethyl)sulfanyl]-6,6-dimethyl-3-(4-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;308289-69-2

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5-benzhydrylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-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：

524.7 g/mol

Exact Mass：

524.15922049 g/mol

Characteristics

PSA：

95.4 Å²

Computed Properties

Molecular Weight:524.7
XLogP3:7.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:524.15922049
Monoisotopic Mass:524.15922049
Topological Polar Surface Area:95.4
Heavy Atom Count:37
Complexity:824
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-benzhydrylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-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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