N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | C521-0860 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(2-methylbenzene-1-sulfonyl)methyl]furan-2-carboxamide |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C21 H19 N O6 S |
| Smiles: | Cc1ccccc1S(Cc1ccc(C(NCc2ccc3c(c2)OCO3)=O)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3184 |
| logD: | 3.3184 |
| logSw: | -3.5618 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.373 |
| InChI Key: | PXPBDXRNLPOZIW-UHFFFAOYSA-N |