N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamide
Chemical Structure Depiction of
N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamide
N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamide
Compound characteristics
| Compound ID: | 2159-3350 |
| Compound Name: | N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamide |
| Molecular Weight: | 481.06 |
| Molecular Formula: | C20 H21 Cl N4 O2 S3 |
| Smiles: | CCCCc1nnc(NC(CCCN2C(/C(=C/c3ccc(cc3)[Cl])SC2=S)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.7637 |
| logD: | 4.6779 |
| logSw: | -5.0033 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.61 |
| InChI Key: | KPTRMFQAEOMRNC-UHFFFAOYSA-N |