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2-[[4-(4-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid

2-[[4-(4-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid structure

CAS No:
727717-72-8
Formula:
C16H12ClN3O2S
Chemical Name:
2-[[4-(4-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
Synonyms:
727717-72-8;2-((4-(4-Chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetic acid;2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid;([4-(4-Chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio)acetic acid;2-[[4-(4-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic Acid;ZINC3369510;MFCD04619486;AKOS005198844;MCULE-3416646614;NE12917;EN300-07017;Z55903860

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2-[[4-(4-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Basic Attributes

Molecular Weight：

345.8 g/mol

Exact Mass：

345.0338755 g/mol

Characteristics

PSA：

93.3 Å²

Computed Properties

Molecular Weight:345.8
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:345.0338755
Monoisotopic Mass:345.0338755
Topological Polar Surface Area:93.3
Heavy Atom Count:23
Complexity:401
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-(4-chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid

Basic Attributes
Characteristics
Computed Properties
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