[5-(3,4-dimethylphenyl)-8-propan-2-yl-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] 2-methylpropanoate
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![[5-(3,4-dimethylphenyl)-8-propan-2-yl-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] 2-methylpropanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b500f80314374aef8e932000dd7cd308.png "[5-(3,4-dimethylphenyl)-8-propan-2-yl-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] 2-methylpropanoate")
[5-(3,4-dimethylphenyl)-8-propan-2-yl-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] 2-methylpropanoate
structure -
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CAS No:
885175-85-9
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Formula:
C27H28N4O2
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Chemical Name:
[5-(3,4-dimethylphenyl)-8-propan-2-yl-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] 2-methylpropanoate
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Synonyms:
ZINC2214263;STK716210;AKOS005534533;MCULE-5518518546;3-(3,4-dimethylphenyl)-5-(propan-2-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 2-methylpropanoate;885175-85-9
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CAS No:
[5-(3,4-dimethylphenyl)-8-propan-2-yl-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] 2-methylpropanoate Basic Attributes
440.5 g/mol
440.22122615 g/mol
Computed Properties
Molecular Weight:440.5
XLogP3:6.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:440.22122615
Monoisotopic Mass:440.22122615
Topological Polar Surface Area:61.4
Heavy Atom Count:33
Complexity:714
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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