Chemical ID: 7016854

CCOc1cccc(c1)C(=O)C2=C(C(=O)N(C2c3ccncc3)Cc4ccncc4)O
Chemical ID:
7016854
Name [?]:
4-(3-ethoxybenzoyl)-3-hydroxy-5-(4-pyridyl)-1-(4-pyridylmethyl)-5H-pyrrol-2-one
SMILES [?]:
CCOc1cccc(c1)C(=O)C2=C(C(=O)N(C2c3ccncc3)Cc4ccncc4)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H21N3O4
All Atoms:52
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:9.27597
Area:639.272
Solvation:-6.70584
Coulombic:-57.962
Bond Count [?]
All:34
Single:22
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:415.441
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.74
LogP (Chemaxon):0.62

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Experimental Annotations

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Descriptor Annotations

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