ethyl 4-imino-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydro-5-pyrimidinecarboxylate
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ethyl 4-imino-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydro-5-pyrimidinecarboxylate
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CAS No:
326923-58-4
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Formula:
C15H15N3O3S
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Chemical Name:
ethyl 4-imino-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydro-5-pyrimidinecarboxylate
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Synonyms:
SMR000102781;ethyl 4-amino-2-phenacylsulfanylpyrimidine-5-carboxylate;MLS000105804;4-amino-2-(phenacylthio)-5-pyrimidinecarboxylic acid ethyl ester;ethyl 4-amino-2-[(2-oxo-2-phenylethyl)sulfanyl]pyrimidine-5-carboxylate;cid_747731;CHEMBL1344216;BDBM75728;CHEBI:123416;HMS1578A01
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CAS No:
ethyl 4-imino-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydro-5-pyrimidinecarboxylate Basic Attributes
317.3629
317.083
Computed Properties
Molecular Weight:317.4
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:317.08341252
Monoisotopic Mass:317.08341252
Topological Polar Surface Area:121
Heavy Atom Count:22
Complexity:388
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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