8-(butylamino)-1,3-dimethyl-7H-purine-2,6-dione
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8-(butylamino)-1,3-dimethyl-7H-purine-2,6-dione
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CAS No:
108776-34-7
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Formula:
C11H17N5O2
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Chemical Name:
8-(butylamino)-1,3-dimethyl-7H-purine-2,6-dione
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Synonyms:
8-(butylamino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione;NSC14113;8-butylamino-theophylline;ZINC1592161;MFCD07656319;NSC-14113;AKOS005858348;MCULE-5969651275;VU0512696-1;F3176-0122;108776-34-7
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CAS No:
8-(butylamino)-1,3-dimethyl-7H-purine-2,6-dione Basic Attributes
251.29 g/mol
251.13822480 g/mol
14113
Computed Properties
Molecular Weight:251.29
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:251.13822480
Monoisotopic Mass:251.13822480
Topological Polar Surface Area:81.3
Heavy Atom Count:18
Complexity:348
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 8-(butylamino)-1,3-dimethyl-7H-purine-2,6-dione
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