Chemical ID: 4558887

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC=Cc3ccccc3
Chemical ID:
4558887
Name [?]:
7-cinnamyl-1,3-dimethyl-purine-2,6-dione
SMILES [?]:
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC=Cc3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H16N4O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.88139
Area:484.078
Solvation:-2.22055
Coulombic:-50.1054
Bond Count [?]
All:24
Single:16
Double:8
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:296.324
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.82
LogP (Chemaxon):2.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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