8-[[(2R)-4-hydroxybutan-2-yl]amino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione
AlkaPlorer ID: AK384414
Synonym: None
IUPAC Name: 8-[[(2R)-4-hydroxybutan-2-yl]amino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione
Structure
SMILES: CC1=CC=CC=C1CN1C(N[C@H](C)CCO)=NC2=C1C(=O)N(C)C(=O)N2C
InChI: InChI=1S/C19H25N5O3/c1-12-7-5-6-8-14(12)11-24-15-16(21-18(24)20-13(2)9-10-25)22(3)19(27)23(4)17(15)26/h5-8,13,25H,9-11H2,1-4H3,(H,20,21)/t13-/m1/s1
InChIKey: FZJZBGDIAQNCMS-CYBMUJFWSA-N
Reference
<i>Laurencia rigida</i>: Chemical Investigations of Its Antifouling Dichloromethane Extract
PubChem CID: 40507587
Source
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Properties Information
Molecule Weight: 371.44100000000014
TPSA？: 94.08
MolLogP？: 0.9732199999999998
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 3
Activities Information
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