5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl 2-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl 2-methoxybenzene-1-sulfonate
5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl 2-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-4438 |
| Compound Name: | 5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl 2-methoxybenzene-1-sulfonate |
| Molecular Weight: | 450.3 |
| Molecular Formula: | C20 H13 Cl2 N O5 S |
| Salt: | not_available |
| Smiles: | COc1ccccc1S(=O)(=O)Oc1cc(ccc1c1nc2cc(ccc2o1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5155 |
| logD: | 5.5155 |
| logSw: | -6.0112 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.527 |
| InChI Key: | YIEPSMSYIQVDOA-UHFFFAOYSA-N |