Chemical ID: 6497986

c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
Chemical ID:
6497986
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
InChi [?]:
InChI=1/C10H6N2O2/c13-10-9-8(11-5-12-9)6-3-1-2-4-7(6)14-10/h1-5H,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,13,5,4,7,8,9,14,12,10,11/rA:14nCCCCCCCCCOONCN/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;d9;s4s9;s8;d12;s7s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H6N2O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.05255
Area:330.542
Solvation:-2.211
Coulombic:-36.4548
Bond Count [?]
All:16
Single:10
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:186.167
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.72
LogP (Chemaxon):1.61

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Descriptor Annotations

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