2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid
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![2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6bca7ff24bc44f8e93fa790dcc428da6.png "2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid")
2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid
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CAS No:
327102-23-8
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Formula:
C21H26N2O6S2
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Chemical Name:
2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid
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Synonyms:
2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid;Oprea1_062361;AE-848/37236064;ZINC2158393;STL360592;AKOS001018232;MCULE-6923066970;SR-01000438542;SR-01000438542-1;2,2"-[(3,3-dimethyl-1,5-dioxopentane-1,5-diyl)diimino]bis(4,5-dimethylthiophene-3-carboxylic acid)
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CAS No:
2-({5-[(3-carboxy-4,5-dimethyl-2-thienyl)amino]-3,3-dimethyl-5-oxopentanoyl}amino)-4,5-dimethyl-3-thiophenecarboxylic acid Basic Attributes
466.57094
466.123
Computed Properties
Molecular Weight:466.6
XLogP3:4.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:466.12322890
Monoisotopic Mass:466.12322890
Topological Polar Surface Area:189
Heavy Atom Count:31
Complexity:673
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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