2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-3-(4-methylphenyl)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-3-(4-methylphenyl)-1,3-thiazolidin-4-one
2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-3-(4-methylphenyl)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4872-0681 |
| Compound Name: | 2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-3-(4-methylphenyl)-1,3-thiazolidin-4-one |
| Molecular Weight: | 467.39 |
| Molecular Formula: | C20 H16 Cl2 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)N1/C(=C(/C(=C([Cl])[Cl])Sc2ccc(C)cc2)[N+]([O-])=O)SCC1=O |
| Stereo: | ACHIRAL |
| logP: | 6.3032 |
| logD: | 6.3032 |
| logSw: | -6.1675 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.385 |
| InChI Key: | ZSZJDJVQRGWWIQ-UHFFFAOYSA-N |