Chemical ID: 6612857

COCCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)F)c3cccc(c3)Oc4ccccc4
Chemical ID:
6612857
Name [?]:
4-(4-fluorobenzoyl)-3-hydroxy-1-(3-methoxypropyl)-5-(3-phenoxyphenyl)-5H-pyrrol-2-one
SMILES [?]:
COCCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)F)c3cccc(c3)Oc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H24FNO5
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:10.0008
Area:688.864
Solvation:-7.2208
Coulombic:-63.1545
Bond Count [?]
All:37
Single:25
Double:12
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:461.482
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.01
LogP (Chemaxon):3.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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