 Home > Encyclopedia > 13-(2-bromoprop-2-enylsulfanyl)-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-(2-bromoprop-2-enylsulfanyl)-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-(2-bromoprop-2-enylsulfanyl)-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:
488708-48-1
Formula:
C20H22BrN3S2
Chemical Name:
13-(2-bromoprop-2-enylsulfanyl)-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:
C20H22BrN3S2;ZINC1830077;STL238634;AKOS025277599;MCULE-2381088500;488708-48-1;8-[(2-bromoprop-2-en-1-yl)sulfanyl]-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

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13-(2-bromoprop-2-enylsulfanyl)-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：

448.4 g/mol

Exact Mass：

447.04385 g/mol

Characteristics

PSA：

92.2 Å²

Computed Properties

Molecular Weight:448.4
XLogP3:6.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:447.04385
Monoisotopic Mass:447.04385
Topological Polar Surface Area:92.2
Heavy Atom Count:26
Complexity:517
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 13-(2-bromoprop-2-enylsulfanyl)-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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