Chemical ID: 5519177

Cc1ccc(cc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C
Chemical ID:
5519177
Name [?]:
1,3-dimethyl-7-[2-oxo-2-(p-tolyl)ethyl]-purine-2,6-dione
SMILES [?]:
Cc1ccc(cc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H16N4O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.86402
Area:497.433
Solvation:-3.57181
Coulombic:-55.7518
Bond Count [?]
All:25
Single:17
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:312.323
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.27
LogP (Chemaxon):1.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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