2-[4-(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)piperazin-1-yl]ethanol
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2-[4-(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)piperazin-1-yl]ethanol
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CAS No:
846027-43-8
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Formula:
C22H29N5OS
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Chemical Name:
2-[4-(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)piperazin-1-yl]ethanol
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Synonyms:
STL304051;ZINC20392035;AKOS022106162;MCULE-1829355881;2-[4-(4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)piperazin-1-yl]ethanol;846027-43-8
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CAS No:
2-[4-(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)piperazin-1-yl]ethanol Basic Attributes
411.6 g/mol
411.20928174 g/mol
Computed Properties
Molecular Weight:411.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:411.20928174
Monoisotopic Mass:411.20928174
Topological Polar Surface Area:93.6
Heavy Atom Count:29
Complexity:545
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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