Chemical ID: 4765694

Cc1ccc(cc1)n2c3c(c(=O)n(c2=O)Cc4ccc(cc4)OC)[nH]cn3
Chemical ID:
4765694
Name [?]:
1-[(4-methoxyphenyl)methyl]-3-(p-tolyl)-7H-purine-2,6-dione
SMILES [?]:
Cc1ccc(cc1)n2c3c(c(=O)n(c2=O)Cc4ccc(cc4)OC)[nH]cn3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18N4O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.0657
Area:554.766
Solvation:-3.80342
Coulombic:-60.5928
Bond Count [?]
All:30
Single:20
Double:10
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:362.382
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.83
LogP (Chemaxon):3.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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