 Home > Encyclopedia > N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide

N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide

N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide structure

CAS No:
79285-13-5
Formula:
C41H60ClN5O4S
Chemical Name:
N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide
Synonyms:
1H-1,2,4-Triazole-1-acetamide,N-[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-;N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide

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N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide Basic Attributes

Molecular Weight：

754.46400

Exact Mass：

754.46

EC Number：

279-127-0

Characteristics

PSA：

147.49000

XLogP3：

11.87080

Density：

1.13g/cm3

Refractive Index：

1.564

Computed Properties

Molecular Weight:754.5
XLogP3:12.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:21
Exact Mass:753.4054543
Monoisotopic Mass:753.4054543
Topological Polar Surface Area:141
Heavy Atom Count:52
Complexity:1130
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[5-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-α-(2,2-dimethyl-1-oxopropyl)-3-(hexylthio)-1H-1,2,4-triazole-1-acetamide

Basic Attributes
Characteristics
Computed Properties

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