pentyl 2-[[8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl]sulfanyl]acetate
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pentyl 2-[[8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl]sulfanyl]acetate
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CAS No:
371134-89-3
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Formula:
C24H31N3O2S2
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Chemical Name:
pentyl 2-[[8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl]sulfanyl]acetate
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Synonyms:
ZINC8837599;STK721395;AKOS005530032;MCULE-8976920954;371134-89-3;pentyl {[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetate
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CAS No:
pentyl 2-[[8-(2-methylpropyl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl]sulfanyl]acetate Basic Attributes
457.7 g/mol
457.18576959 g/mol
Computed Properties
Molecular Weight:457.7
XLogP3:7.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:457.18576959
Monoisotopic Mass:457.18576959
Topological Polar Surface Area:119
Heavy Atom Count:31
Complexity:593
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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