2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide
-
![2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e0ca29bb2a854d439f3fad9ce6d4faa6.png "2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide")
2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide
structure -
-
CAS No:
763085-98-9
-
Formula:
C20H17F3N4O3S
-
Chemical Name:
2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide
-
Synonyms:
ZINC2623975;AKOS033450344;MCULE-5592621773;AB00725977-01;Z15911057;2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,2,2-trifluoroethyl)acetamide;763085-98-9
-
CAS No:
2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide Basic Attributes
450.4 g/mol
450.09734608 g/mol
Computed Properties
Molecular Weight:450.4
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:450.09734608
Monoisotopic Mass:450.09734608
Topological Polar Surface Area:104
Heavy Atom Count:31
Complexity:609
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation