 Home > Encyclopedia > 12-benzylsulfanyl-7-propan-2-yl-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-benzylsulfanyl-7-propan-2-yl-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-benzylsulfanyl-7-propan-2-yl-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:
799828-75-4
Formula:
C22H21N3S2
Chemical Name:
12-benzylsulfanyl-7-propan-2-yl-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:
ZINC2240688;STK721629;AKOS005530433;MCULE-8558499641;7-(benzylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine;799828-75-4

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12-benzylsulfanyl-7-propan-2-yl-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：

391.6 g/mol

Exact Mass：

391.11769003 g/mol

Characteristics

PSA：

92.2 Å²

Computed Properties

Molecular Weight:391.6
XLogP3:6.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:391.11769003
Monoisotopic Mass:391.11769003
Topological Polar Surface Area:92.2
Heavy Atom Count:27
Complexity:510
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 12-benzylsulfanyl-7-propan-2-yl-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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