Chemical ID: 5175183

CC(Cc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C
Chemical ID:
5175183
Name [?]:
1,3-dimethyl-7-[2-(1-methyl-2-phenyl-ethyl)aminoethyl]purine-2,6-dione
SMILES [?]:
CC(Cc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H23N5O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:11.2355
Area:552.396
Solvation:-2.5744
Coulombic:-57.9578
Bond Count [?]
All:27
Single:20
Double:7
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:341.408
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.45
LogP (Chemaxon):2.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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