Chemical ID: 4133745

COCCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)OCC=C)c3ccc(c(c3)OC)O
Chemical ID:
4133745
Name [?]:
4-(4-allyloxybenzoyl)-3-hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one
SMILES [?]:
COCCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)OCC=C)c3ccc(c(c3)OC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27NO7
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:8.09431
Area:704.328
Solvation:-9.51389
Coulombic:-81.5362
Bond Count [?]
All:35
Single:25
Double:10
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:453.484
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:3.41
LogP (Chemaxon):2.06

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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