Chemical ID: 5651992

CCCCn1c2ccccc2n(c1=[NH2+])CC(=O)c3cc(c(c(c3)C(C)(C)C)O)C(C)(C)C
Chemical ID:
5651992
Name [?]:
[1-butyl-3-[2-(4-hydroxy-3,5-ditert-butyl-phenyl)-2-oxo-ethyl]-benzoimidazol-2-ylidene]ammonium
SMILES [?]:
CCCCn1c2ccccc2n(c1=[NH2+])CC(=O)c3cc(c(c(c3)C(C)(C)C)O)C(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H38N3O2+
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:-22.0459
Area:690.574
Solvation:-39.3103
Coulombic:-42.3774
Bond Count [?]
All:34
Single:26
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:436.61
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:7.37
LogP (Chemaxon):6.79

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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