4-(8-benzylsulfanyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide
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4-(8-benzylsulfanyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide
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CAS No:
77749-76-9
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Formula:
C21H25N7OS2
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Chemical Name:
4-(8-benzylsulfanyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide
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Synonyms:
8-benzylthio-4-(1-oxido-thiomorpholino)-2-piperazino-pyrimido-[5,4-d]-pyrimidine; Pyrimido(5,4-d)pyrimidine,8-((phenylmethyl)thio)-2-(1-piperazinyl)-4-(4-thiomorpholinyl)-,S-oxide; 4-[4-(phenylmethylsulfanyl)-6-piperazin-1-ylpyrimido[6,5-e]pyrimidin-8-yl]-1,4-thiazinane 1-oxide;
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CAS No:
4-(8-benzylsulfanyl-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-4-yl)-1,4-thiazinane 1-oxide Basic Attributes
455.60000
455.15620079
DTXSID00228368
Computed Properties
Molecular Weight:455.6
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:455.15620079
Monoisotopic Mass:455.15620079
Topological Polar Surface Area:132
Heavy Atom Count:31
Complexity:592
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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