5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl ethanesulfonate
Chemical Structure Depiction of
5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl ethanesulfonate
5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V029-9611 |
| Compound Name: | 5-chloro-2-(5-chloro-1,3-benzoxazol-2-yl)phenyl ethanesulfonate |
| Molecular Weight: | 372.22 |
| Molecular Formula: | C15 H11 Cl2 N O4 S |
| Salt: | not_available |
| Smiles: | CCS(=O)(=O)Oc1cc(ccc1c1nc2cc(ccc2o1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.587 |
| logD: | 4.587 |
| logSw: | -4.765 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.244 |
| InChI Key: | TUZSCITYVRHRCQ-UHFFFAOYSA-N |