Chemical ID: 5235255

c1ccc-2c(c1)Cc3c2nncc3
Chemical ID:
5235255
Name [?]:
None
SMILES [?]:
c1ccc-2c(c1)Cc3c2nncc3
InChi [?]:
InChI=1/C11H8N2/c1-2-4-10-8(3-1)7-9-5-6-12-13-11(9)10/h1-6H,7H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,13,12,7,5,8,4,9,11,10/rA:13nCCCCCCCCCNNCC/rB:s1;d2;s3;d4;d1s5;s5;s7;s4s8;d9;s10;d11;d8s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H8N2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.35237
Area:322.331
Solvation:-1.70592
Coulombic:-4.01265
Bond Count [?]
All:15
Single:9
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:168.195
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.7
LogP (Chemaxon):1.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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