Chemical ID: 7540503

Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
Chemical ID:
7540503
Name [?]:
None
SMILES [?]:
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
InChi [?]:
InChI=1/C11H9N3O2/c1-6-5-9(15)14-4-3-8-10(11(14)12-6)16-7(2)13-8/h3-5H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,16,8,7,3,2,14,9,4,10,11,12,15,6,5,13/rA:16nCCCCONCCCCCNOCNC/rB:s1;d2;s3;d4;s4;s6;d7;s8;d9;s6s10;s2d11;s10;s13;s9d14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H9N3O2
All Atoms:25
Heavy Atoms:16
Chiral Atoms:None
ZAP Information [?]
Total:6.90409
Area:373.504
Solvation:-2.4335
Coulombic:-33.5788
Bond Count [?]
All:18
Single:12
Double:6
Rotors:0
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:0.21
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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