3-anilino-2-(2,3,3-trichloro-1-nitroprop-2-en-1-ylidene)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-anilino-2-(2,3,3-trichloro-1-nitroprop-2-en-1-ylidene)-1,3-thiazolidin-4-one
3-anilino-2-(2,3,3-trichloro-1-nitroprop-2-en-1-ylidene)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4872-0282 |
| Compound Name: | 3-anilino-2-(2,3,3-trichloro-1-nitroprop-2-en-1-ylidene)-1,3-thiazolidin-4-one |
| Molecular Weight: | 380.63 |
| Molecular Formula: | C12 H8 Cl3 N3 O3 S |
| Smiles: | C1C(N(/C(=C(/C(=C([Cl])[Cl])[Cl])[N+]([O-])=O)S1)Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8578 |
| logD: | 3.8578 |
| logSw: | -4.2958 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.49 |
| InChI Key: | YARAIPXUHDBVQD-UHFFFAOYSA-N |