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

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

7-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-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:
578697-76-4
Formula:
C20H19N5O3S2
Chemical Name:
7-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-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:
ZINC2386124;STK720477;AKOS005529231;MCULE-4902940723;4-ethyl-1-[(4-nitrobenzyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;578697-76-4

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7-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-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：

441.5 g/mol

Exact Mass：

441.09293183 g/mol

Characteristics

PSA：

150 Å²

Computed Properties

Molecular Weight:441.5
XLogP3:4.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:441.09293183
Monoisotopic Mass:441.09293183
Topological Polar Surface Area:150
Heavy Atom Count:30
Complexity:671
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-ethyl-3-[(4-nitrophenyl)methylsulfanyl]-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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