Chemical ID: 5573674

CCOC1C(=CNc2ccc(c(c2)C(=O)O)O)C(=O)c3cc(ccc3O1)C
Chemical ID:
5573674
Name [?]:
5-[(2-ethoxy-6-methyl-4-oxo-chroman-3-ylidene)methylamino]-2-hydroxy-benzoic acid
SMILES [?]:
CCOC1C(=CNc2ccc(c(c2)C(=O)O)O)C(=O)c3cc(ccc3O1)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H19NO6
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:8.75785
Area:573.627
Solvation:-5.58283
Coulombic:-79.1169
Bond Count [?]
All:29
Single:20
Double:9
Rotors:5
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:369.368
H-Bond Donors:3
H-Bond Acceptors:7
XLogP:3.85
LogP (Chemaxon):3.68

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue