N-[2-(phenylsulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[2-(phenylsulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[2-(phenylsulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y031-0856 |
| Compound Name: | N-[2-(phenylsulfanyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 349.41 |
| Molecular Formula: | C20 H15 N O3 S |
| Smiles: | C1Oc2ccc(cc2O1)C(Nc1ccccc1Sc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6799 |
| logD: | 4.6799 |
| logSw: | -4.8071 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.476 |
| InChI Key: | AXLIPRJKPXMCIF-UHFFFAOYSA-N |