4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzonitrile
Chemical Structure Depiction of
4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzonitrile
4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzonitrile
Compound characteristics
| Compound ID: | 3972-1974 |
| Compound Name: | 4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzonitrile |
| Molecular Weight: | 356.85 |
| Molecular Formula: | C17 H9 Cl N2 O S2 |
| Smiles: | C(=C1/C(N(C(=S)S1)c1cccc(c1)[Cl])=O)/c1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2398 |
| logD: | 4.2398 |
| logSw: | -4.7367 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 32.887 |
| InChI Key: | ZVFNOIVBUKOXPR-UHFFFAOYSA-N |