4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid
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![4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6d52e3ffe2cb44b3bfa951a44cf98e1a.png "4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid")
4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid
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CAS No:
796107-16-9
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Formula:
C18H16N4O3S2
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Chemical Name:
4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
MLS000760992;4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]benzoic acid;SMR000372297;4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid;CHEMBL1555850;BDBM60206;cid_2490212;CHEBI:109738;HMS2732K24;ZINC3372440;AKOS033693602;MCULE-5504638505;SR-01000061869;SR-01000061869-1;Q27189010;Z19592528;4-[[2-[[5-(m-toluidino)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]benzoic acid;4-[2-({5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoic acid;4-[2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]benzoic acid;796107-16-9
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CAS No:
4-[[2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoic acid Basic Attributes
400.5 g/mol
400.06638273 g/mol
Computed Properties
Molecular Weight:400.5
XLogP3:3.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:400.06638273
Monoisotopic Mass:400.06638273
Topological Polar Surface Area:158
Heavy Atom Count:27
Complexity:517
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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