 Home > Encyclopedia > 5-[(E)-3-chlorobut-2-enyl]sulfanyl-7-ethylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

5-[(E)-3-chlorobut-2-enyl]sulfanyl-7-ethylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

5-[(E)-3-chlorobut-2-enyl]sulfanyl-7-ethylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene structure

CAS No:
489422-98-2
Formula:
C17H19ClN4S3
Chemical Name:
5-[(E)-3-chlorobut-2-enyl]sulfanyl-7-ethylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Synonyms:
C17H19ClN4S3;ZINC2266160;STK548338;AKOS005476280;3-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-5-(ethylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine;489422-98-2

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5-[(E)-3-chlorobut-2-enyl]sulfanyl-7-ethylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene Basic Attributes

Molecular Weight：

411.0 g/mol

Exact Mass：

410.0460378 g/mol

Characteristics

PSA：

122 Å²

Computed Properties

Molecular Weight:411.0
XLogP3:6.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:410.0460378
Monoisotopic Mass:410.0460378
Topological Polar Surface Area:122
Heavy Atom Count:25
Complexity:508
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(E)-3-chlorobut-2-enyl]sulfanyl-7-ethylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

Basic Attributes
Characteristics
Computed Properties

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