3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl methanesulfonate
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl methanesulfonate
3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl methanesulfonate
Compound characteristics
| Compound ID: | Y041-5476 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl methanesulfonate |
| Molecular Weight: | 337.78 |
| Molecular Formula: | C15 H12 Cl N O4 S |
| Smiles: | CS(=O)(=O)Oc1ccc2c(Cc3ccc(cc3)[Cl])noc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6453 |
| logD: | 3.6453 |
| logSw: | -4.1223 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.81 |
| InChI Key: | IHGVDAMVDMKURL-UHFFFAOYSA-N |