Chemical ID: 6461894

COc1ccc(cc1)N=C2NC(=O)C(=Cc3ccc(c(c3OC)OC)OC)S2
Chemical ID:
6461894
Name [?]:
2-(4-methoxyphenyl)imino-5-[(2,3,4-trimethoxyphenyl)methylene]thiazolidin-4-one
SMILES [?]:
COc1ccc(cc1)N=C2NC(=O)C(=Cc3ccc(c(c3OC)OC)OC)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H20N2O5S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:8.55421
Area:609.237
Solvation:-6.67672
Coulombic:-57.8187
Bond Count [?]
All:30
Single:21
Double:9
Rotors:6
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:400.449
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.35
LogP (Chemaxon):3.34

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