 Home > Encyclopedia > 13-heptylsulfanyl-4,4-dimethyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

13-heptylsulfanyl-4,4-dimethyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

13-heptylsulfanyl-4,4-dimethyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene structure

CAS No:
573695-98-4
Formula:
C27H31N3OS2
Chemical Name:
13-heptylsulfanyl-4,4-dimethyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene
Synonyms:
STK721679;ZINC97953070;AKOS005530315;MCULE-4000887387;573695-98-4;8-(heptylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine

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13-heptylsulfanyl-4,4-dimethyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene Basic Attributes

Molecular Weight：

477.7 g/mol

Exact Mass：

477.19085497 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:477.7
XLogP3:7.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:477.19085497
Monoisotopic Mass:477.19085497
Topological Polar Surface Area:101
Heavy Atom Count:33
Complexity:629
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 13-heptylsulfanyl-4,4-dimethyl-8-phenyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

Basic Attributes
Characteristics
Computed Properties

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