Chemical ID: 7012131

c1ccc(cc1)CN2C(C(=C(C2=O)O)C(=O)c3ccc(cc3)Cl)c4cccnc4
Chemical ID:
7012131
Name [?]:
1-benzyl-4-(4-chlorobenzoyl)-3-hydroxy-5-(3-pyridyl)-5H-pyrrol-2-one
SMILES [?]:
c1ccc(cc1)CN2C(C(=C(C2=O)O)C(=O)c3ccc(cc3)Cl)c4cccnc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H17ClN2O3
All Atoms:46
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:9.74992
Area:578.065
Solvation:-4.7017
Coulombic:-49.0285
Bond Count [?]
All:32
Single:20
Double:12
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:404.845
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.28
LogP (Chemaxon):2.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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