Chemical ID: 4591116

c1ccc(cc1)c2nnc3n2nc(cc3)Cl
Chemical ID:
4591116
Name [?]:
4-chloro-7-phenyl-5,6,8,9-tetrazabicyclo[4.3.0]nona-2,4,7,9-tetraene
SMILES [?]:
c1ccc(cc1)c2nnc3n2nc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H7ClN4
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.47242
Area:393.003
Solvation:-1.35265
Coulombic:-13.4282
Bond Count [?]
All:18
Single:11
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:230.653
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.73
LogP (Chemaxon):2.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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