Chemical ID: 3965661

c1ccc(cc1)CNC(=O)C(=Cc2ccc(c(c2)O)O)C#N
Chemical ID:
3965661
Name [?]:
N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)-prop-2-enamide
SMILES [?]:
c1ccc(cc1)CNC(=O)C(=Cc2ccc(c(c2)O)O)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H14N2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.35507
Area:510.728
Solvation:-4.41312
Coulombic:-58.4156
Bond Count [?]
All:23
Single:14
Double:8
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:294.305
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:3.25
LogP (Chemaxon):2.59

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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