2-(2-phenylethylcarbamothioylamino)-1,3-thiazole-4-carboxylic acid
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2-(2-phenylethylcarbamothioylamino)-1,3-thiazole-4-carboxylic acid
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CAS No:
149486-83-9
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Formula:
C13H13N3O2S2
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Chemical Name:
2-(2-phenylethylcarbamothioylamino)-1,3-thiazole-4-carboxylic acid
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Synonyms:
PETT Analog 44; PETT COOH deriv.;
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CAS No:
2-(2-phenylethylcarbamothioylamino)-1,3-thiazole-4-carboxylic acid Basic Attributes
307.39100
307.04491901
DTXSID50164308
Computed Properties
Molecular Weight:307.4
XLogP3:2.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:307.04491901
Monoisotopic Mass:307.04491901
Topological Polar Surface Area:135
Heavy Atom Count:20
Complexity:349
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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