Chemical ID: 4770220

COc1c(cccc1Cl)c2cn3ccccc3n2
Chemical ID:
4770220
Name [?]:
8-(3-chloro-2-methoxy-phenyl)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene
SMILES [?]:
COc1c(cccc1Cl)c2cn3ccccc3n2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H11ClN2O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.32861
Area:418.33
Solvation:-3.12964
Coulombic:-19.4426
Bond Count [?]
All:20
Single:13
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:258.703
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.48
LogP (Chemaxon):3.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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