2-cyano-2-[7-(3,4-dichlorophenyl)-5-hydroxy-2H-1,3-benzoxathiol-2-ylidene]acetamide
Chemical Structure Depiction of
2-cyano-2-[7-(3,4-dichlorophenyl)-5-hydroxy-2H-1,3-benzoxathiol-2-ylidene]acetamide
2-cyano-2-[7-(3,4-dichlorophenyl)-5-hydroxy-2H-1,3-benzoxathiol-2-ylidene]acetamide
Compound characteristics
| Compound ID: | 5786-2385 |
| Compound Name: | 2-cyano-2-[7-(3,4-dichlorophenyl)-5-hydroxy-2H-1,3-benzoxathiol-2-ylidene]acetamide |
| Molecular Weight: | 379.22 |
| Molecular Formula: | C16 H8 Cl2 N2 O3 S |
| Smiles: | C(\C(=C1/Oc2c(cc(cc2S1)O)c1ccc(c(c1)[Cl])[Cl])C(N)=O)#N |
| Stereo: | ACHIRAL |
| logP: | 3.9181 |
| logD: | 3.9177 |
| logSw: | -4.3469 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.262 |
| InChI Key: | STDQFXFXKPYGLU-UHFFFAOYSA-N |