Chemical ID: 6637689

CCOC(=O)C1=C(NC(=C(C1C=Cc2cc(c(c(c2)OC)O)OC)C(=O)OCC)C)C
Chemical ID:
6637689
Name [?]:
diethyl 4-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SMILES [?]:
CCOC(=O)C1=C(NC(=C(C1C=Cc2cc(c(c(c2)OC)O)OC)C(=O)OCC)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H29NO7
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:8.90282
Area:611.598
Solvation:-6.38714
Coulombic:-80.3416
Bond Count [?]
All:32
Single:24
Double:8
Rotors:10
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:431.479
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:3.77
LogP (Chemaxon):0.72

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