N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
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N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
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CAS No:
749918-18-1
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Formula:
C22H21F3N4O2
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Chemical Name:
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
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Synonyms:
ZINC2655280;AKOS033992844;MCULE-3152621678;Z27146425;749918-18-1;N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
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CAS No:
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2-[3-(trifluoromethyl)phenoxy]acetamide Basic Attributes
430.4 g/mol
430.16166041 g/mol
Computed Properties
Molecular Weight:430.4
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:430.16166041
Monoisotopic Mass:430.16166041
Topological Polar Surface Area:69
Heavy Atom Count:31
Complexity:598
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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