N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)methyl]sulfanyl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y031-2622 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 384.28 |
| Molecular Formula: | C17 H15 Cl2 N O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CSCc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8097 |
| logD: | 4.8097 |
| logSw: | -4.9184 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.554 |
| InChI Key: | PAPIWVAKHLCPAS-UHFFFAOYSA-N |