 Home > Encyclopedia > 2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone

2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone

2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone structure

CAS No:
848740-08-9
Formula:
C20H19N5OS2
Chemical Name:
2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone
Synonyms:
ZINC2432170;STL232614;AKOS025272882;MCULE-2497332776;2-[(5-amino-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-1-(4-methylphenyl)ethanone;848740-08-9

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2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone Basic Attributes

Molecular Weight：

409.5 g/mol

Exact Mass：

409.10310259 g/mol

Characteristics

PSA：

140 Å²

Computed Properties

Molecular Weight:409.5
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:409.10310259
Monoisotopic Mass:409.10310259
Topological Polar Surface Area:140
Heavy Atom Count:28
Complexity:587
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(7-amino-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-methylphenyl)ethanone

Basic Attributes
Characteristics
Computed Properties

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