2-(5-chloro-1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-(5-chloro-1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate
2-(5-chloro-1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-4489 |
| Compound Name: | 2-(5-chloro-1,3-benzoxazol-2-yl)-4-methylphenyl 2-methoxybenzene-1-sulfonate |
| Molecular Weight: | 429.88 |
| Molecular Formula: | C21 H16 Cl N O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)c1nc2cc(ccc2o1)[Cl])OS(c1ccccc1OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0012 |
| logD: | 5.0012 |
| logSw: | -4.975 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.527 |
| InChI Key: | PKGJYKVOEZLKRF-UHFFFAOYSA-N |