 Home > Encyclopedia > ethyl 2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate

ethyl 2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate

ethyl 2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate structure

CAS No:
38911-92-1
Formula:
C22H23N5O3S
Chemical Name:
ethyl 2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Synonyms:
Acetic acid,((5-(2-(1H-benzimidazol-2-yl)ethyl)-4-(p-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-,ethyl ester; {5-[2-(1H-benzoimidazol-2-yl)-ethyl]-4-(4-methoxy-phenyl)-4H-[1,2,4]triazol-3-ylsulfanyl}-acetic acid ethyl ester; ETHYL 2-[[5-[2-(1H-BENZOIMIDAZOL-2-YL)ETHYL]-4-(4-METHOXYPHENYL)-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETATE;

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ethyl 2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Basic Attributes

Molecular Weight：

437.51500

Exact Mass：

437.15216079 g/mol

DSSTox ID：

DTXSID40192155

Characteristics

PSA：

120.22000

XLogP3：

3.59260

Density：

1.34g/cm3

Boiling Point：

705.2ºC

Flash Point：

380.3ºC

Refractive Index：

1.666

Computed Properties

Molecular Weight:437.5
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:437.15216079
Monoisotopic Mass:437.15216079
Topological Polar Surface Area:120
Heavy Atom Count:31
Complexity:577
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate

Basic Attributes
Characteristics
Computed Properties
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