4-amino-5-(2-methylpropyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylic acid
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4-amino-5-(2-methylpropyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylic acid
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CAS No:
13164-82-4
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Formula:
C9H13N3O2S
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Chemical Name:
4-amino-5-(2-methylpropyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylic acid
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Synonyms:
6-amino-5-isobutyl-2-thioxo-1,2-dihydro-pyrimidine-4-carboxylic acid; 5-Isobutyl-2-mercapto-6-amino-4-carboxypyrimidin;
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CAS No:
4-amino-5-(2-methylpropyl)-2-sulfanylidene-1H-pyrimidine-6-carboxylic acid Basic Attributes
227.28300
227.07284784
154935
DTXSID70402032
2933599090
Computed Properties
Molecular Weight:227.29
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:227.07284784
Monoisotopic Mass:227.07284784
Topological Polar Surface Area:120
Heavy Atom Count:15
Complexity:372
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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