Chemical ID: 7659815

c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
Chemical ID:
7659815
Name [?]:
None
SMILES [?]:
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
InChi [?]:
InChI=1/C7H5N7O/c15-6-4-5(9-2-10-6)13-7(12-4)14-3-8-1-11-14/h1-3H,(H2,9,10,12,13,15)
InChi Info:
AuxInfo=1/1/N:14,1,12,5,6,3,9,13,7,2,15,10,8,11,4/rA:15nCNCOCCNNCNNCNCN/rB:s1;s2;d3;s3;d5;d1s6;s6;s8;s5d9;s9;s11;d12;s13;s11d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H5N7O
All Atoms:20
Heavy Atoms:15
Chiral Atoms:None
ZAP Information [?]
Total:6.08751
Area:355.395
Solvation:-2.79735
Coulombic:-53.5523
Bond Count [?]
All:17
Single:11
Double:6
Rotors:1
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:-1.09
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue