 Home > Encyclopedia > 12-[(2-methylphenyl)methylsulfanyl]-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

12-[(2-methylphenyl)methylsulfanyl]-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

12-[(2-methylphenyl)methylsulfanyl]-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene structure

CAS No:
799808-84-7
Formula:
C24H25N3S2
Chemical Name:
12-[(2-methylphenyl)methylsulfanyl]-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene
Synonyms:
Oprea1_583921;ZINC2229481;STL227032;AKOS025272344;MCULE-2958868495;7-[(2-methylbenzyl)sulfanyl]-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine;799808-84-7

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12-[(2-methylphenyl)methylsulfanyl]-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene Basic Attributes

Molecular Weight：

419.6 g/mol

Exact Mass：

419.14899016 g/mol

Characteristics

PSA：

92.2 Å²

Computed Properties

Molecular Weight:419.6
XLogP3:7.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:419.14899016
Monoisotopic Mass:419.14899016
Topological Polar Surface Area:92.2
Heavy Atom Count:29
Complexity:558
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 12-[(2-methylphenyl)methylsulfanyl]-7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

Basic Attributes
Characteristics
Computed Properties

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