[({[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetyl)amino]acetic acid
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![[({[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetyl)amino]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2be0e8729e5149a1a4d0bc06951f0c94.png "[({[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetyl)amino]acetic acid")
[({[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetyl)amino]acetic acid
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CAS No:
723748-25-2
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Formula:
C18H14F3N3O3S
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Chemical Name:
[({[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetyl)amino]acetic acid
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Synonyms:
723748-25-2;2-(2-{[6-benzyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamido)acetic acid;AM-807/42859957;MLS001178359;KS-00003RMD;HMS2795L19;ZINC4620511;RSC001264;AKOS004112837;MCULE-1369658880
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CAS No:
[({[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetyl)amino]acetic acid Basic Attributes
409.3822696
409.071
Computed Properties
Molecular Weight:409.4
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:409.07079698
Monoisotopic Mass:409.07079698
Topological Polar Surface Area:128
Heavy Atom Count:28
Complexity:602
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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