Chemical ID: 4558568

Cn1cnc2c1c(=O)n(c(=O)n2C)Cc3ccc(cc3)OC
Chemical ID:
4558568
Name [?]:
1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione
SMILES [?]:
Cn1cnc2c1c(=O)n(c(=O)n2C)Cc3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H16N4O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.31549
Area:469.296
Solvation:-3.41691
Coulombic:-55.4334
Bond Count [?]
All:24
Single:17
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:300.313
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.13
LogP (Chemaxon):1.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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