Chemical ID: 4148931

CCCOc1ccc(cc1OC)C=C2C(=O)N(C(=S)S2)c3ccccc3
Chemical ID:
4148931
Name [?]:
5-[(3-methoxy-4-propoxy-phenyl)methylene]-3-phenyl-2-thioxo-thiazolidin-4-one
SMILES [?]:
CCCOc1ccc(cc1OC)C=C2C(=O)N(C(=S)S2)c3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H19NO3S2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.96694
Area:595.022
Solvation:-4.90861
Coulombic:-34.4309
Bond Count [?]
All:28
Single:19
Double:9
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:385.502
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.74
LogP (Chemaxon):4.79

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