[5-(4-butylphenyl)-8-propyl-5,7,9,16-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(16),2(6),3,7,10,12,14-heptaen-3-yl] butanoate
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[5-(4-butylphenyl)-8-propyl-5,7,9,16-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(16),2(6),3,7,10,12,14-heptaen-3-yl] butanoate
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CAS No:
885195-99-3
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Formula:
C29H32N4O2
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Chemical Name:
[5-(4-butylphenyl)-8-propyl-5,7,9,16-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(16),2(6),3,7,10,12,14-heptaen-3-yl] butanoate
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Synonyms:
ZINC2439275;STK991205;AKOS005646275;MCULE-4007677388;3-(4-butylphenyl)-5-propyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl butanoate;885195-99-3
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CAS No:
[5-(4-butylphenyl)-8-propyl-5,7,9,16-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(16),2(6),3,7,10,12,14-heptaen-3-yl] butanoate Basic Attributes
468.6 g/mol
468.25252628 g/mol
Computed Properties
Molecular Weight:468.6
XLogP3:7.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:468.25252628
Monoisotopic Mass:468.25252628
Topological Polar Surface Area:61.4
Heavy Atom Count:35
Complexity:696
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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