N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C523-0589 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C23 H24 N2 O6 S |
| Smiles: | Cc1c(CSCC(NCc2ccc3c(c2)OCO3)=O)nc(c2ccc(c(c2)OC)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.5898 |
| logD: | 3.5898 |
| logSw: | -3.8237 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.937 |
| InChI Key: | RTQDVQCSBMUASI-UHFFFAOYSA-N |