pentyl 2-[(8-propan-2-yl-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-propan-2-yl-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:
488827-49-2
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Formula:
C23H29N3O2S2
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Chemical Name:
pentyl 2-[(8-propan-2-yl-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:
ZINC9272226;STK542007;AKOS005471420;MCULE-2805889794;488827-49-2;pentyl {[5-(propan-2-yl)-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-propan-2-yl-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
443.6 g/mol
443.17011952 g/mol
Computed Properties
Molecular Weight:443.6
XLogP3:7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:443.17011952
Monoisotopic Mass:443.17011952
Topological Polar Surface Area:119
Heavy Atom Count:30
Complexity:579
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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