[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate
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![[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a4c552ceb36a49b98e92d952dd17c53e.png "[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate")
[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate
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CAS No:
747410-77-1
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Formula:
C23H21FN4O3S
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Chemical Name:
[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate
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Synonyms:
ZINC9612744;AKOS033437346;MCULE-6906338922;NCGC00315545-01;AB01310525-01;Z15733854;[(2-cyanoethyl)(4-fluorophenyl)carbamoyl]methyl 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate;747410-77-1
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CAS No:
[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 2-[2-amino-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate Basic Attributes
452.5 g/mol
452.13183988 g/mol
Computed Properties
Molecular Weight:452.5
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:452.13183988
Monoisotopic Mass:452.13183988
Topological Polar Surface Area:138
Heavy Atom Count:32
Complexity:686
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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