2-(1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-(1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate
2-(1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-4417 |
| Compound Name: | 2-(1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate |
| Molecular Weight: | 395.43 |
| Molecular Formula: | C21 H17 N O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)c1nc2ccccc2o1)OS(c1ccccc1OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5657 |
| logD: | 4.5657 |
| logSw: | -4.5728 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.527 |
| InChI Key: | SGXPHOCAPDWTIU-UHFFFAOYSA-N |