 Home > Encyclopedia > 3-(3-methylbutylsulfanyl)-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-(3-methylbutylsulfanyl)-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-(3-methylbutylsulfanyl)-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one structure

CAS No:
371956-75-1
Formula:
C22H24N4OS2
Chemical Name:
3-(3-methylbutylsulfanyl)-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Synonyms:
ZINC2270919;STK830833;AKOS005608896;MCULE-9834847045;1-[(3-methylbutyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;371956-75-1

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3-(3-methylbutylsulfanyl)-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one Basic Attributes

Molecular Weight：

424.6 g/mol

Exact Mass：

424.13915375 g/mol

Characteristics

PSA：

105 Å²

Computed Properties

Molecular Weight:424.6
XLogP3:5.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:424.13915375
Monoisotopic Mass:424.13915375
Topological Polar Surface Area:105
Heavy Atom Count:29
Complexity:599
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3-methylbutylsulfanyl)-7-phenyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

Basic Attributes
Characteristics
Computed Properties

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