4-(5-{3-[4-(3-chloroanilino)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(3-chlorophenyl)butanamide
Chemical Structure Depiction of
4-(5-{3-[4-(3-chloroanilino)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(3-chlorophenyl)butanamide
4-(5-{3-[4-(3-chloroanilino)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(3-chlorophenyl)butanamide
Compound characteristics
| Compound ID: | 2159-2999 |
| Compound Name: | 4-(5-{3-[4-(3-chloroanilino)-4-oxobutyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-N-(3-chlorophenyl)butanamide |
| Molecular Weight: | 653.65 |
| Molecular Formula: | C26 H22 Cl2 N4 O4 S4 |
| Smiles: | C(CC(Nc1cccc(c1)[Cl])=O)CN1C(/C(=C2/C(N(CCCC(Nc3cccc(c3)[Cl])=O)C(=S)S2)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6788 |
| logD: | 4.6786 |
| logSw: | -4.7708 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.173 |
| InChI Key: | BOMHGJABWQJFDH-UHFFFAOYSA-N |