3-[[2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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![3-[[2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/16cd55763ce04446baff1d0425a48b66.png "3-[[2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid")
3-[[2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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CAS No:
727421-56-9
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Formula:
C17H15N5O3S
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Chemical Name:
3-[[2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
ZINC1443611;STK522993;AKOS003934391;MCULE-5647830037;Z54339483;3-({[(4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid;3-{2-[(4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid;727421-56-9
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CAS No:
3-[[2-[(4-amino-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid Basic Attributes
369.4 g/mol
369.08956053 g/mol
Computed Properties
Molecular Weight:369.4
XLogP3:2.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:369.08956053
Monoisotopic Mass:369.08956053
Topological Polar Surface Area:148
Heavy Atom Count:26
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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