 Home > Encyclopedia > 4-[[2-[[4-(4-chlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid

4-[[2-[[4-(4-chlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid

4-[[2-[[4-(4-chlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid structure

CAS No:
896818-50-1
Formula:
C21H15ClN4O4S
Chemical Name:
4-[[2-[[4-(4-chlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid
Synonyms:
ZINC2208362;STK573652;AKOS005498482;MCULE-7612051416;4-[({[4-(4-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid;896818-50-1

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4-[[2-[[4-(4-chlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid Basic Attributes

Molecular Weight：

454.9 g/mol

Exact Mass：

454.0502538 g/mol

Characteristics

PSA：

136 Å²

Computed Properties

Molecular Weight:454.9
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:454.0502538
Monoisotopic Mass:454.0502538
Topological Polar Surface Area:136
Heavy Atom Count:31
Complexity:629
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[[2-[[4-(4-chlorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid

Basic Attributes
Characteristics
Computed Properties
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