methyl 3-{[5-chloro-2-(4-methyl-1,3-benzoxazol-2-yl)phenoxy]sulfonyl}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[5-chloro-2-(4-methyl-1,3-benzoxazol-2-yl)phenoxy]sulfonyl}thiophene-2-carboxylate
methyl 3-{[5-chloro-2-(4-methyl-1,3-benzoxazol-2-yl)phenoxy]sulfonyl}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | V003-5112 |
| Compound Name: | methyl 3-{[5-chloro-2-(4-methyl-1,3-benzoxazol-2-yl)phenoxy]sulfonyl}thiophene-2-carboxylate |
| Molecular Weight: | 463.91 |
| Molecular Formula: | C20 H14 Cl N O6 S2 |
| Smiles: | Cc1cccc2c1nc(c1ccc(cc1OS(c1ccsc1C(=O)OC)(=O)=O)[Cl])o2 |
| Stereo: | ACHIRAL |
| logP: | 5.3326 |
| logD: | 5.3326 |
| logSw: | -5.8752 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.859 |
| InChI Key: | QFELCXKHTIQKPG-UHFFFAOYSA-N |