5-[[(2,5-dichlorophenyl)amino]methyl]-1-(2-methylphenyl)-3-(4-phenyl-1 ,3-thiazol-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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5-[[(2,5-dichlorophenyl)amino]methyl]-1-(2-methylphenyl)-3-(4-phenyl-1 ,3-thiazol-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
structure -
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CAS No:
139356-80-2
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Formula:
C27H20Cl2N4O2S2
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Chemical Name:
5-[[(2,5-dichlorophenyl)amino]methyl]-1-(2-methylphenyl)-3-(4-phenyl-1 ,3-thiazol-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
4,6(1H,5H)-Pyrimidinedione,5-[[(2,5-dichlorophenyl)amino]methyl]dihydro-1-(2-methylphenyl)-3-(4-phenyl-2-thiazolyl)-2-thioxo-;ACMC-1C1T5;CTK4C1774;DTXSID00930454;4,6(1H,5H)-Pyrimidinedione, dihydro-5-(((2,5-dichlorophenyl)amino)methl)-1-(2-methylphenyl)-3-(4-phenyl-2-thiazolyl)-2-thioxo-;5-[(2,5-dichloroanilino)methyl]-1-(2-methylphenyl)-3-(4-phenyl-1,3-thiazol-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione;LS-135212
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CAS No:
5-[[(2,5-dichlorophenyl)amino]methyl]-1-(2-methylphenyl)-3-(4-phenyl-1 ,3-thiazol-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
567.503
566.04
Computed Properties
Molecular Weight:567.5
XLogP3:7.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:566.0404736
Monoisotopic Mass:566.0404736
Topological Polar Surface Area:126
Heavy Atom Count:37
Complexity:860
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
5-[[(2,5-dichlorophenyl)amino]methyl]-1-(2-methylphenyl)-3-(4-phenyl-1 ,3-thiazol-2-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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