2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione
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![2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b951416a126345ee8f3a5c60ce9218a8.png "2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione")
2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione
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CAS No:
726199-67-3
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Formula:
C19H13ClN4O2S
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Chemical Name:
2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione
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Synonyms:
7-[(4-chlorobenzyl)sulfanyl]-3-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione;MLS000331914;CHEMBL1375250;HMS2581P12;ZINC9331897;STK210154;STK848531;AKOS001717724;AKOS005628240;MCULE-4746660289;SMR000221405;ST079338;7-(4-Chloro-benzylsulfanyl)-3-phenyl-1H-pyrimido[4,5-d]pyrimidine-2,4-dione;7-[(4-chlorobenzyl)sulfanyl]-2-hydroxy-3-phenylpyrimido[4,5-d]pyrimidin-4(3H)-one;7-[(4-chlorobenzyl)thio]-3-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione;7-[(4-chlorophenyl)methylthio]-3-phenyl-1,3-dihydropyrimidino[4,5-d]pyrimidine -2,4-dione;726199-67-3
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CAS No:
2-[(4-chlorophenyl)methylsulfanyl]-6-phenyl-8H-pyrimido[4,5-d]pyrimidine-5,7-dione Basic Attributes
396.9 g/mol
396.0447745 g/mol
Computed Properties
Molecular Weight:396.9
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:396.0447745
Monoisotopic Mass:396.0447745
Topological Polar Surface Area:101
Heavy Atom Count:27
Complexity:552
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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