2-(5-chloro-1,3-benzoxazol-2-yl)-6-methylphenyl 2,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-(5-chloro-1,3-benzoxazol-2-yl)-6-methylphenyl 2,4-dichlorobenzene-1-sulfonate
2-(5-chloro-1,3-benzoxazol-2-yl)-6-methylphenyl 2,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V003-5072 |
| Compound Name: | 2-(5-chloro-1,3-benzoxazol-2-yl)-6-methylphenyl 2,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 468.74 |
| Molecular Formula: | C20 H12 Cl3 N O4 S |
| Smiles: | Cc1cccc(c1OS(c1ccc(cc1[Cl])[Cl])(=O)=O)c1nc2cc(ccc2o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.3418 |
| logD: | 6.3418 |
| logSw: | -6.3307 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.984 |
| InChI Key: | LLNIYSWTCYEEGT-UHFFFAOYSA-N |