Chemical ID: 4723878

Cc1ccn2c(c1)[nH+]c(c2CN(C)C)c3ccc(cc3)Cl
Chemical ID:
4723878
Name [?]:
1-[8-(4-chlorophenyl)-4-methyl-1-aza-7-azoniabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl]-N,N-dimethyl-methanamine
SMILES [?]:
Cc1ccn2c(c1)[nH+]c(c2CN(C)C)c3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H19ClN3+
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:-18.0888
Area:486.307
Solvation:-30.2464
Coulombic:-10.0023
Bond Count [?]
All:23
Single:16
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:300.806
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.83
LogP (Chemaxon):4.06

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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