 Home > Encyclopedia > 13-[(4-methoxyphenyl)methylsulfanyl]-8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaene

13-[(4-methoxyphenyl)methylsulfanyl]-8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaene

13-[(4-methoxyphenyl)methylsulfanyl]-8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaene structure

CAS No:
500146-31-6
Formula:
C25H27N3OS2
Chemical Name:
13-[(4-methoxyphenyl)methylsulfanyl]-8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaene
Synonyms:
ZINC1800676;STK926083;AKOS005642172;MCULE-2884629401;500146-31-6;8-[(4-methoxybenzyl)sulfanyl]-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

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13-[(4-methoxyphenyl)methylsulfanyl]-8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaene Basic Attributes

Molecular Weight：

449.6 g/mol

Exact Mass：

449.15955484 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:449.6
XLogP3:7.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:449.15955484
Monoisotopic Mass:449.15955484
Topological Polar Surface Area:101
Heavy Atom Count:31
Complexity:585
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 13-[(4-methoxyphenyl)methylsulfanyl]-8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaene

Basic Attributes
Characteristics
Computed Properties

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