2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]acetamide
-
![2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a292b78008484e91a178a7113540bf05.png "2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]acetamide")
2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]acetamide
structure -
-
CAS No:
134793-44-5
-
Formula:
C21H27F3N8O2S
-
Chemical Name:
2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]acetamide
-
Synonyms:
NSC623091;134793-44-5;2,4-Di(piperazinylmethyl)-3-thioxo-6-(2-trifluoroacetylaminophenyl)-1,2,4-triazine-5(2H,4H)-one;Acetamide, 2,2,2-trifluoro-N-(2-(2,3,4,5-tetrahydro-5-oxo-2,4-bis(1-piperazinylmethyl)-3-thioxo-1,2,4-triazin-6-yl)phenyl)-;Acetamide, 2,2,2-trifluoro-N-[2-[2,3,4,5-tetrahydro-5-oxo-2,4-bis(1-piperazinylmethyl)-3-thioxo-1,2,4-triazin-6-yl]phenyl]-;NSC 623091;CHEMBL2003555;DTXSID60158950;ZINC19365209;NSC-623091;NCI60_006881;2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-thioxo-1,2,4-triazin-6-yl]phenyl]acetamide;2,3-Dihydro-2,4-bis[(piperazin-1-yl)methyl]-3-thioxo-6-[2-[(trifluoroacetyl)amino]phenyl]-1,2,4-triazin-5(4H)-one
-
CAS No:
2,2,2-trifluoro-N-[2-[5-oxo-2,4-bis(piperazin-1-ylmethyl)-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]acetamide Basic Attributes
512.6 g/mol
512.19297779 g/mol
623091
DTXSID60158950
Computed Properties
Molecular Weight:512.6
XLogP3:1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:6
Exact Mass:512.19297779
Monoisotopic Mass:512.19297779
Topological Polar Surface Area:128
Heavy Atom Count:35
Complexity:830
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation