[(4-ALLYL-5-OXO-4,5-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-1-YL)THIO]ACETIC ACID
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![[(4-ALLYL-5-OXO-4,5-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-1-YL)THIO]ACETIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2715bdc4106f48618305d198a49514aa.png "[(4-ALLYL-5-OXO-4,5-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-1-YL)THIO]ACETIC ACID")
[(4-ALLYL-5-OXO-4,5-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-1-YL)THIO]ACETIC ACID
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CAS No:
742094-79-7
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Formula:
C14H12N4O3S
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Chemical Name:
[(4-ALLYL-5-OXO-4,5-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-1-YL)THIO]ACETIC ACID
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Synonyms:
[(4-allyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)thio]acetic acid;2-{[5-oxo-4-(prop-2-en-1-yl)-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetic acid;MLS001170834;CHEMBL1874044;CTK8F2252;HMS2851F09;ZINC3311576;AKOS005198675;MCULE-1210133047;NE25961
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CAS No:
[(4-ALLYL-5-OXO-4,5-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]QUINAZOLIN-1-YL)THIO]ACETIC ACID Basic Attributes
316.34
316.063
Computed Properties
Molecular Weight:316.34
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:316.06301143
Monoisotopic Mass:316.06301143
Topological Polar Surface Area:114
Heavy Atom Count:22
Complexity:475
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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