Chemical ID: 7012439

c1ccc(cc1)CCN2C(C(=C(C2=O)O)C(=O)c3ccccc3)c4cccnc4
Chemical ID:
7012439
Name [?]:
4-benzoyl-3-hydroxy-1-phenethyl-5-(3-pyridyl)-5H-pyrrol-2-one
SMILES [?]:
c1ccc(cc1)CCN2C(C(=C(C2=O)O)C(=O)c3ccccc3)c4cccnc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H20N2O3
All Atoms:49
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:10.3776
Area:598.062
Solvation:-4.57399
Coulombic:-49.538
Bond Count [?]
All:32
Single:20
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:384.427
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.81
LogP (Chemaxon):2.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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