Chemical ID: 6836117

Cc1cccc2n1cc(n2)c3ccccc3
Chemical ID:
6836117
Name [?]:
5-methyl-8-phenyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraene
SMILES [?]:
Cc1cccc2n1cc(n2)c3ccccc3
InChi [?]:
InChI=1/C14H12N2/c1-11-6-5-9-14-15-13(10-16(11)14)12-7-3-2-4-8-12/h2-10H,1H3
InChi Info:
AuxInfo=1/0/N:1,14,13,15,4,3,12,16,5,8,2,11,9,6,10,7/E:(3,4)(7,8)/rA:16nCCCCCCNCCNCCCCCC/rB:s1;d2;s3;d4;s5;s2s6;s7;d8;d6s9;s9;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12N2
All Atoms:28
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.99896
Area:384.533
Solvation:-1.61435
Coulombic:-12.8011
Bond Count [?]
All:18
Single:11
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:208.259
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.18
LogP (Chemaxon):3.44

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