3-[(3-chloro-4-methylanilino)methyl]-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-[(3-chloro-4-methylanilino)methyl]-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
3-[(3-chloro-4-methylanilino)methyl]-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 1207-0071 |
| Compound Name: | 3-[(3-chloro-4-methylanilino)methyl]-5-(3-phenylprop-2-en-1-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 400.95 |
| Molecular Formula: | C20 H17 Cl N2 O S2 |
| Smiles: | Cc1ccc(cc1[Cl])NCN1C(/C(=C\C=C\c2ccccc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1323 |
| logD: | 6.1323 |
| logSw: | -6.0826 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6021 |
| InChI Key: | DEIJZVWFYRMEHC-HYZSBJHASA-N |