Chemical ID: 4861883

CN(C)CCCN1C(C(=C(C1=O)O)C(=O)c2ccccc2)c3cccc(c3)OCC=C
Chemical ID:
4861883
Name [?]:
5-(3-allyloxyphenyl)-4-benzoyl-1-(3-dimethylaminopropyl)-3-hydroxy-5H-pyrrol-2-one
SMILES [?]:
CN(C)CCCN1C(C(=C(C1=O)O)C(=O)c2ccccc2)c3cccc(c3)OCC=C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H28N2O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:11.1728
Area:662.988
Solvation:-5.40192
Coulombic:-58.0393
Bond Count [?]
All:33
Single:23
Double:10
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:420.501
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.94
LogP (Chemaxon):-0.09

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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