methyl 2-({[2-(1,3-benzoxazol-2-yl)-5-chlorophenoxy]sulfonyl}methyl)benzoate
Chemical Structure Depiction of
methyl 2-({[2-(1,3-benzoxazol-2-yl)-5-chlorophenoxy]sulfonyl}methyl)benzoate
methyl 2-({[2-(1,3-benzoxazol-2-yl)-5-chlorophenoxy]sulfonyl}methyl)benzoate
Compound characteristics
| Compound ID: | V030-7038 |
| Compound Name: | methyl 2-({[2-(1,3-benzoxazol-2-yl)-5-chlorophenoxy]sulfonyl}methyl)benzoate |
| Molecular Weight: | 457.89 |
| Molecular Formula: | C22 H16 Cl N O6 S |
| Salt: | not_available |
| Smiles: | COC(c1ccccc1CS(=O)(=O)Oc1cc(ccc1c1nc2ccccc2o1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3452 |
| logD: | 5.3452 |
| logSw: | -5.8582 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.146 |
| InChI Key: | LUFMRJYAFSNNOC-UHFFFAOYSA-N |