Chemical ID: 6185408

CCOc1ccc(cc1)[N+]2=C3CCCCCN3C(C2)(c4ccccc4)O
Chemical ID:
6185408
Name [?]:
10-(4-ethoxyphenyl)-8-phenyl-7-aza-10-azoniabicyclo[5.3.0]dec-10-en-8-ol
SMILES [?]:
CCOc1ccc(cc1)[N+]2=C3CCCCCN3C(C2)(c4ccccc4)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H27N2O2+
All Atoms:26
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:-13.8472
Area:560.463
Solvation:-27.8587
Coulombic:-15.7247
Bond Count [?]
All:29
Single:22
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:351.462
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.66
LogP (Chemaxon):1.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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