Chemical ID: 6503481

c1ccc2c(c1)ncc3n2ncc3
Chemical ID:
6503481
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ncc3n2ncc3
InChi [?]:
InChI=1/C10H7N3/c1-2-4-10-9(3-1)11-7-8-5-6-12-13(8)10/h1-7H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,13,12,8,9,5,4,7,11,10/rA:13nCCCCCCNCCNNCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;s4s9;s10;d11;d9s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H7N3
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.8485
Area:316.735
Solvation:-2.06988
Coulombic:-9.88686
Bond Count [?]
All:15
Single:9
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:169.183
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.51
LogP (Chemaxon):2.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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