Chemical ID: 4591394

CCOc1ccc(cc1)c2cn3cc(ccc3n2)Cl
Chemical ID:
4591394
Name [?]:
3-chloro-8-(4-ethoxyphenyl)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene
SMILES [?]:
CCOc1ccc(cc1)c2cn3cc(ccc3n2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H13ClN2O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.94373
Area:466.007
Solvation:-2.70645
Coulombic:-19.9285
Bond Count [?]
All:21
Single:14
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:272.729
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.82
LogP (Chemaxon):4.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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