 Home > Encyclopedia > 2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure

CAS No:
379730-18-4
Formula:
C26H27ClN4OS
Chemical Name:
2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Synonyms:
ZINC3227398;AKOS034458595;MCULE-6134375686;Z56827885;2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carbothioamide;379730-18-4

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2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes

Molecular Weight：

479.0 g/mol

Exact Mass：

478.1594104 g/mol

Characteristics

PSA：

75.6 Å²

Computed Properties

Molecular Weight:479.0
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:478.1594104
Monoisotopic Mass:478.1594104
Topological Polar Surface Area:75.6
Heavy Atom Count:33
Complexity:667
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-(4-methylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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