Chemical ID: 4562078

CN(C)CCCn1cnc2c1c(=O)[nH]c(=O)n2Cc3ccccc3
Chemical ID:
4562078
Name [?]:
3-benzyl-7-(3-dimethylaminopropyl)purine-2,6-dione
SMILES [?]:
CN(C)CCCn1cnc2c1c(=O)[nH]c(=O)n2Cc3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H21N5O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.3646
Area:527.606
Solvation:-2.8255
Coulombic:-57.4712
Bond Count [?]
All:26
Single:19
Double:7
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.381
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.28
LogP (Chemaxon):-1.23

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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