4-[8-benzylsulfanyl-2-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]-1,4-thiazinane 1-oxide
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4-[8-benzylsulfanyl-2-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]-1,4-thiazinane 1-oxide
structure -
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CAS No:
77777-01-6
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Formula:
C22H27N7OS2
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Chemical Name:
4-[8-benzylsulfanyl-2-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]-1,4-thiazinane 1-oxide
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Synonyms:
4-[6-(4-methylpiperazin-1-yl)-4-(phenylmethylsulfanyl)pyrimido[6,5-e]pyrimidin-8-yl]-1,4-thiazinane 1-oxide; Pyrimido(5,4-d)pyrimidine,2-(4-methyl-1-piperazinyl)-8-((phenylmethyl)thio)-4-(4-thiomorpholinyl)-,S-oxide; 8-Benzylthio-2-(N-methyl-piperazino)-4-(1-oxidothiomorpholino)pyrimido(5,4-d)pyrimidine;
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CAS No:
4-[8-benzylsulfanyl-2-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]-1,4-thiazinane 1-oxide Basic Attributes
469.62600
469.17185086
DTXSID90228392
Computed Properties
Molecular Weight:469.6
XLogP3:1.8
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:469.17185086
Monoisotopic Mass:469.17185086
Topological Polar Surface Area:123
Heavy Atom Count:32
Complexity:619
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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