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

N-(2,3-dimethylphenyl)-6-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

N-(2,3-dimethylphenyl)-6-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure

CAS No:
488717-52-8
Formula:
C33H33N3OS
Chemical Name:
N-(2,3-dimethylphenyl)-6-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Synonyms:
ZINC2336991;STK998751;AKOS016365801;MCULE-6972337505;488717-52-8;N-(2,3-dimethylphenyl)-1-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide

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N-(2,3-dimethylphenyl)-6-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes

Molecular Weight：

519.7 g/mol

Exact Mass：

519.23443386 g/mol

Characteristics

PSA：

62.7 Å²

Computed Properties

Molecular Weight:519.7
XLogP3:8.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:519.23443386
Monoisotopic Mass:519.23443386
Topological Polar Surface Area:62.7
Heavy Atom Count:38
Complexity:806
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2,3-dimethylphenyl)-6-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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