2-[4-[(2-chlorobenzoyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
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![2-[4-[(2-chlorobenzoyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/481b661a976e41d6b24a47f132756d20.png "2-[4-[(2-chlorobenzoyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid")
2-[4-[(2-chlorobenzoyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
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CAS No:
385379-50-0
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Formula:
C22H21ClN6O4S
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Chemical Name:
2-[4-[(2-chlorobenzoyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid
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Synonyms:
2-(4-{[(2-chlorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid;SR-01000505940;Oprea1_232201;MLS000777788;CHEMBL1570463;SCHEMBL16690451;HMS2764N18;ZINC2338038;STK543548;AKOS001673187;MCULE-8586435777;SMR000414273;SR-01000505940-1;SR-01000505940-3;2-(4-{[(2-chlorobenzoyl)amino]carbonothioyl}piperazin-1-yl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid;2-[4-(2-Chloro-benzoylaminocarbothioyl)-piperazin-1-yl]-8-ethyl-5-oxo-5,8-dihydro-pyrido[2,3-d]pyrimidi ne-6-carboxylic acid;385379-50-0
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CAS No:
2-[4-[(2-chlorobenzoyl)carbamothioyl]piperazin-1-yl]-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid Basic Attributes
501.0 g/mol
500.1033520 g/mol
Computed Properties
Molecular Weight:501.0
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:500.1033520
Monoisotopic Mass:500.1033520
Topological Polar Surface Area:151
Heavy Atom Count:34
Complexity:864
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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