 Home > Encyclopedia > [2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]-phenylmethanone

[2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]-phenylmethanone

[2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]-phenylmethanone structure

CAS No:
731826-40-7
Formula:
C31H29N3O2
Chemical Name:
[2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]-phenylmethanone
Synonyms:
ZINC3296484;AKOS034468037;MCULE-6079922955;Z56955847;5-benzoyl-2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene;731826-40-7

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[2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]-phenylmethanone Basic Attributes

Molecular Weight：

475.6 g/mol

Exact Mass：

475.22597718 g/mol

Characteristics

PSA：

48.5 Å²

Computed Properties

Molecular Weight:475.6
XLogP3:6.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:475.22597718
Monoisotopic Mass:475.22597718
Topological Polar Surface Area:48.5
Heavy Atom Count:36
Complexity:738
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: ethyl acetoacetate; thiophene; ammonium bicarbonate; nitrogen trifluoride; chlorphenamine maleate; benzaldehyde molar mass

Guide of [2-[(3,5-dimethylphenoxy)methyl]-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]-phenylmethanone

Basic Attributes
Characteristics
Computed Properties

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