Chemical ID: 4803449

C=CCOc1cccc(c1)C2C(=C(C(=O)N2Cc3ccncc3)O)C(=O)c4ccc5c(c4)OCCO5
Chemical ID:
4803449
Name [?]:
5-(3-allyloxyphenyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-3-hydroxy-1-(4-pyridylmethyl)-5H-pyrrol-2-one
SMILES [?]:
C=CCOc1cccc(c1)C2C(=C(C(=O)N2Cc3ccncc3)O)C(=O)c4ccc5c(c4)OCCO5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H24N2O6
All Atoms:36
Heavy Atoms:36
Chiral Atoms:1
ZAP Information [?]
Total:10.5693
Area:723.677
Solvation:-7.52261
Coulombic:-72.0127
Bond Count [?]
All:40
Single:27
Double:13
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:484.5
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.81
LogP (Chemaxon):1.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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