Chemical ID: 6488479

c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
Chemical ID:
6488479
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
InChi [?]:
InChI=1/C11H5N3O3/c15-9-6-4-2-1-3-5(6)7-8(9)13-11(17)14-10(16)12-7/h1-4H,(H,14,16,17)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,7,8,16,13,10,15,9,12,17,14,11/rA:17nCCCCCCCCNCONCONCO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;s10;s12;d13;d7s13;s4s8;d16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H5N3O3
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.51764
Area:379.793
Solvation:-2.97717
Coulombic:-53.6195
Bond Count [?]
All:19
Single:11
Double:8
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:227.176
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:-0.49
LogP (Chemaxon):1.02

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Descriptor Annotations

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