2-[4-[(6-chloropyridine-3-carbonyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
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![2-[4-[(6-chloropyridine-3-carbonyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/714a9a4355b146ad96454bfe115de978.png "2-[4-[(6-chloropyridine-3-carbonyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid")
2-[4-[(6-chloropyridine-3-carbonyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
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CAS No:
489398-67-6
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Formula:
C21H20ClN7O4S
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Chemical Name:
2-[4-[(6-chloropyridine-3-carbonyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
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Synonyms:
C21H20ClN7O4S;ZINC2192563;STK769922;AKOS001737931;MCULE-3049548502;2-(4-{[(6-chloropyridin-3-yl)carbonyl]carbamothioyl}piperazin-1-yl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid;2-[4-({[(6-chloro-3-pyridyl)carbonyl]amino}carbothioyl)piperazino]-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid;489398-67-6
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CAS No:
2-[4-[(6-chloropyridine-3-carbonyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid Basic Attributes
501.9 g/mol
501.0986010 g/mol
Computed Properties
Molecular Weight:501.9
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:4
Exact Mass:501.0986010
Monoisotopic Mass:501.0986010
Topological Polar Surface Area:164
Heavy Atom Count:34
Complexity:866
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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