1-[2-[[4-(4-ethylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxylic acid
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![1-[2-[[4-(4-ethylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e6e82acc3f7441c185b67d88b20aa1a2.png "1-[2-[[4-(4-ethylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxylic acid")
1-[2-[[4-(4-ethylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxylic acid
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CAS No:
735336-20-6
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Formula:
C23H25N5O3S
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Chemical Name:
1-[2-[[4-(4-ethylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxylic acid
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Synonyms:
MLS000775800;CHEMBL1723426;HMS2717C21;ZINC3320286;AKOS033632823;MCULE-7826956225;SMR000369371;Z18588423;1-(2-{[4-(4-ethylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxylic acid;735336-20-6
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CAS No:
1-[2-[[4-(4-ethylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-4-carboxylic acid Basic Attributes
451.5 g/mol
451.16781085 g/mol
Computed Properties
Molecular Weight:451.5
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:451.16781085
Monoisotopic Mass:451.16781085
Topological Polar Surface Area:127
Heavy Atom Count:32
Complexity:631
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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