2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid
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![2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dbf586aceb13474ea474359b3ff3277f.png "2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid")
2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid
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CAS No:
93965-05-0
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Formula:
C23H21Cl2N9O11S3
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Chemical Name:
2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid
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Synonyms:
1,4-Benzenedisulfonic acid,2-[[4-chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-;1,4-Benzenedisulfonic acid,2-[[4-chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-;2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid
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CAS No:
2-[[4-Chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-5-[2-[1-(2-chloro-5-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-1,4-benzenedisulfonic acid Basic Attributes
766.56800
766.57
300-953-5
Computed Properties
Molecular Weight:766.6
XLogP3:1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:9
Exact Mass:764.9899714
Monoisotopic Mass:764.9899714
Topological Polar Surface Area:309
Heavy Atom Count:48
Complexity:1580
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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