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Dibenzothioline

Dibenzothioline structure

CAS No:
59316-76-6
Formula:
C31H31N3O8S2
Chemical Name:
Dibenzothioline
Synonyms:
2,6-(dihydroxymethylpyridine)-bis(S-benzoylthio)propionylglycine;dibenzothioline;Glycine, N-(2-(benzoylthio)-1-oxopropyl)-, 2,6-pyridinediylbis(methylene) ester

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Dibenzothioline Basic Attributes

Molecular Weight：

637.731

Exact Mass：

637.155

Characteristics

PSA：

208

XLogP3：

Density：

1.329±0.06 g/cm3(Predicted)

Drug Information

MeSH Entry Terms：

2,6-(dihydroxymethylpyridine)-bis(S-benzoylthio)propionylglycine

Computed Properties

Molecular Weight:637.7
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:18
Exact Mass:637.15525730
Monoisotopic Mass:637.15525730
Topological Polar Surface Area:208
Heavy Atom Count:44
Complexity:924
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Dibenzothioline

Basic Attributes
Characteristics
Drug Information
Computed Properties

Dibenzothioline

SDS

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