2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide
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2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide
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CAS No:
763093-04-5
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Formula:
C20H17ClFN5O2S
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Chemical Name:
2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide
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Synonyms:
ZINC2625298;AKOS033929015;MCULE-4749393830;Z24955504;2-{[5-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide;763093-04-5
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CAS No:
2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide Basic Attributes
445.9 g/mol
445.0775518 g/mol
Computed Properties
Molecular Weight:445.9
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:445.0775518
Monoisotopic Mass:445.0775518
Topological Polar Surface Area:120
Heavy Atom Count:30
Complexity:615
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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