Chemical ID: 7016803

COc1cccc(c1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)O)Cc4ccncc4)O
Chemical ID:
7016803
Name [?]:
3-hydroxy-5-(4-hydroxyphenyl)-4-(3-methoxybenzoyl)-1-(4-pyridylmethyl)-5H-pyrrol-2-one
SMILES [?]:
COc1cccc(c1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)O)Cc4ccncc4)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H20N2O5
All Atoms:51
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:8.7437
Area:631.864
Solvation:-7.05291
Coulombic:-70.088
Bond Count [?]
All:34
Single:22
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:416.426
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.17
LogP (Chemaxon):1.58

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Experimental Annotations

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Descriptor Annotations

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