 Home > Encyclopedia > 9-benzyl-16,17-dimethyl-2,9,13,20-tetrazapentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),3,5,7,10,12,14(19),15,17-nonaene-11-carbonitrile

9-benzyl-16,17-dimethyl-2,9,13,20-tetrazapentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),3,5,7,10,12,14(19),15,17-nonaene-11-carbonitrile

9-benzyl-16,17-dimethyl-2,9,13,20-tetrazapentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),3,5,7,10,12,14(19),15,17-nonaene-11-carbonitrile structure

CAS No:
327080-21-7
Formula:
C26H19N5
Chemical Name:
9-benzyl-16,17-dimethyl-2,9,13,20-tetrazapentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),3,5,7,10,12,14(19),15,17-nonaene-11-carbonitrile
Synonyms:
Oprea1_673811;ZINC3192101;AKOS034455014;MCULE-6261569202;Z56789529;327080-21-7;9-benzyl-16,17-dimethyl-2,9,13,20-tetraazapentacyclo[10.8.0.0^{2,10}.0^{3,8}.0^{14,19}]icosa-1(20),3(8),4,6,10,12,14,16,18-nonaene-11-carbonitrile

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9-benzyl-16,17-dimethyl-2,9,13,20-tetrazapentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),3,5,7,10,12,14(19),15,17-nonaene-11-carbonitrile Basic Attributes

Molecular Weight：

401.5 g/mol

Exact Mass：

401.16404563 g/mol

Characteristics

PSA：

58.9 Å²

Computed Properties

Molecular Weight:401.5
XLogP3:5.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:401.16404563
Monoisotopic Mass:401.16404563
Topological Polar Surface Area:58.9
Heavy Atom Count:31
Complexity:710
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-benzyl-16,17-dimethyl-2,9,13,20-tetrazapentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),3,5,7,10,12,14(19),15,17-nonaene-11-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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