Chemical ID: 7411999

Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
Chemical ID:
7411999
Name [?]:
None
SMILES [?]:
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
InChi [?]:
InChI=1/C9H8N4O3/c1-4-3-13-5-6(10-9(13)16-4)12(2)8(15)11-7(5)14/h3H,1-2H3,(H,11,14,15)
InChi Info:
AuxInfo=1/1/N:1,16,3,2,5,12,6,9,14,13,8,11,4,7,10,15/rA:16nCCCNCCONCONCNCOC/rB:s1;d2;s3;s4;s5;d6;s6;s8;d9;s9;d5s11;s12;s4d13;s2s14;s11;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8N4O3
All Atoms:24
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:6.61669
Area:367.394
Solvation:-2.56816
Coulombic:-58.9978
Bond Count [?]
All:18
Single:13
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:220.185
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.07
LogP (Chemaxon):0.7

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Descriptor Annotations

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