Chemical ID: 4126371

Cc1cc(ccc1OCC=C)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)F)CCN(C)C)O
Chemical ID:
4126371
Name [?]:
4-(4-allyloxy-3-methyl-benzoyl)-1-(2-dimethylaminoethyl)-5-(4-fluorophenyl)-3-hydroxy-5H-pyrrol-2-one
SMILES [?]:
Cc1cc(ccc1OCC=C)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)F)CCN(C)C)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27FN2O4
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.758
Area:686.485
Solvation:-6.40415
Coulombic:-60.5871
Bond Count [?]
All:34
Single:24
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:438.491
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.97
LogP (Chemaxon):0.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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