N-(4-ethoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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![N-(4-ethoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4664eaa97ae04784a8a8bb87cf50aff9.png "N-(4-ethoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
N-(4-ethoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
540773-20-4
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Formula:
C30H28N4OS
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Chemical Name:
N-(4-ethoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
Oprea1_681243;ZINC2251008;STK634056;AKOS005566312;MCULE-8902896067;540773-20-4;N-(4-ethoxyphenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
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CAS No:
N-(4-ethoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
492.6 g/mol
492.19838270 g/mol
Computed Properties
Molecular Weight:492.6
XLogP3:6.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:492.19838270
Monoisotopic Mass:492.19838270
Topological Polar Surface Area:75.6
Heavy Atom Count:36
Complexity:731
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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