2-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2,4-dichlorobenzene-1-sulfonate
2-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-7062 |
| Compound Name: | 2-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 448.32 |
| Molecular Formula: | C21 H15 Cl2 N O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc2c(c1)nc(c1cccc(C)c1OS(c1ccc(cc1[Cl])[Cl])(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.1217 |
| logD: | 6.1217 |
| logSw: | -6.2198 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.984 |
| InChI Key: | XIHMZLZEDNZSEK-UHFFFAOYSA-N |