N-(2-adamantyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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N-(2-adamantyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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CAS No:
799807-87-7
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Formula:
C25H27N5OS
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Chemical Name:
N-(2-adamantyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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Synonyms:
ZINC2228777;STL240842;AKOS001085676;MCULE-7498686236;2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(tricyclo[3.3.1.1~3,7~]dec-2-yl)acetamide;799807-87-7
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CAS No:
N-(2-adamantyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Basic Attributes
445.6 g/mol
445.19363168 g/mol
Computed Properties
Molecular Weight:445.6
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:445.19363168
Monoisotopic Mass:445.19363168
Topological Polar Surface Area:98
Heavy Atom Count:32
Complexity:643
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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