Chemical ID: 5741498

Cc1ccccc1COc2ccc(cc2)C(=C3C(N(C(=O)C3=O)CCC[NH+](C)C)c4cccc(c4)O)[O-]
Chemical ID:
5741498
Name [?]:
[1-(3-dimethylammoniopropyl)-2-(3-hydroxyphenyl)-4,5-dioxo-pyrrolidin-3-ylidene]-[4-(o-tolylmethoxy)phenyl]-methanolate
SMILES [?]:
Cc1ccccc1COc2ccc(cc2)C(=C3C(N(C(=O)C3=O)CCC[NH+](C)C)c4cccc(c4)O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H32N2O5
All Atoms:37
Heavy Atoms:37
Chiral Atoms:1
ZAP Information [?]
Total:-42.3075
Area:713.18
Solvation:-60.137
Coulombic:-26.536
Bond Count [?]
All:40
Single:28
Double:12
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:500.586
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.42
LogP (Chemaxon):0.47

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Descriptor Annotations

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