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

N-(4-ethylphenyl)-6-(4-methoxyphenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

N-(4-ethylphenyl)-6-(4-methoxyphenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure

CAS No:
540500-21-8
Formula:
C31H30N4OS
Chemical Name:
N-(4-ethylphenyl)-6-(4-methoxyphenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Synonyms:
Oprea1_011299;ZINC2245904;STK628627;AKOS005561513;MCULE-2100614351;540500-21-8;N-(4-ethylphenyl)-4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide

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N-(4-ethylphenyl)-6-(4-methoxyphenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes

Molecular Weight：

506.7 g/mol

Exact Mass：

506.21403277 g/mol

Characteristics

PSA：

75.6 Å²

Computed Properties

Molecular Weight:506.7
XLogP3:7.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:506.21403277
Monoisotopic Mass:506.21403277
Topological Polar Surface Area:75.6
Heavy Atom Count:37
Complexity:758
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(4-ethylphenyl)-6-(4-methoxyphenyl)-2-phenyl-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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