 Home > Encyclopedia > 2-[2-[[7-(4-methylphenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]ethyl]isoindole-1,3-dione

2-[2-[[7-(4-methylphenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]ethyl]isoindole-1,3-dione

2-[2-[[7-(4-methylphenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]ethyl]isoindole-1,3-dione structure

CAS No:
799800-51-4
Formula:
C28H23N5O3S2
Chemical Name:
2-[2-[[7-(4-methylphenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]ethyl]isoindole-1,3-dione
Synonyms:
C28H23N5O3S2;ZINC2223172;STK553514;AKOS005480728;MCULE-1327865514;2-(2-((5-oxo-4-(p-tolyl)-4,5,6,7,8,9-hexahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)ethyl)isoindoline-1,3-dione;2-(2-{[4-(4-methylphenyl)-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione;799800-51-4

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2-[2-[[7-(4-methylphenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]ethyl]isoindole-1,3-dione Basic Attributes

Molecular Weight：

541.6 g/mol

Exact Mass：

541.12423196 g/mol

Characteristics

PSA：

142 Å²

Computed Properties

Molecular Weight:541.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:541.12423196
Monoisotopic Mass:541.12423196
Topological Polar Surface Area:142
Heavy Atom Count:38
Complexity:937
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[2-[[7-(4-methylphenyl)-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]ethyl]isoindole-1,3-dione

Basic Attributes
Characteristics
Computed Properties

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