 Home > Encyclopedia > 5-[(4-chlorophenyl)methylsulfanyl]-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine

5-[(4-chlorophenyl)methylsulfanyl]-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine

5-[(4-chlorophenyl)methylsulfanyl]-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine structure

CAS No:
578743-82-5
Formula:
C18H16ClN5S2
Chemical Name:
5-[(4-chlorophenyl)methylsulfanyl]-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine
Synonyms:
MLS-0463468.0001;CHEMBL1975000;BDBM87086;cid_2220412;ZINC2867425;STK845416;AKOS005627570;MCULE-1327762621;3-[(4-chlorobenzyl)sulfanyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-5-amine;578743-82-5

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5-[(4-chlorophenyl)methylsulfanyl]-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine Basic Attributes

Molecular Weight：

401.9 g/mol

Exact Mass：

401.0535656 g/mol

Characteristics

PSA：

123 Å²

Computed Properties

Molecular Weight:401.9
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:401.0535656
Monoisotopic Mass:401.0535656
Topological Polar Surface Area:123
Heavy Atom Count:26
Complexity:506
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(4-chlorophenyl)methylsulfanyl]-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine

Basic Attributes
Characteristics
Computed Properties

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