N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[(4-methoxybenzene-1-sulfonyl)amino]methyl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[(4-methoxybenzene-1-sulfonyl)amino]methyl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[(4-methoxybenzene-1-sulfonyl)amino]methyl}benzamide
Compound characteristics
| Compound ID: | K783-0115 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[(4-methoxybenzene-1-sulfonyl)amino]methyl}benzamide |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C23 H22 N2 O6 S |
| Smiles: | COc1ccc(cc1)S(NCc1ccc(cc1)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2866 |
| logD: | 3.2865 |
| logSw: | -3.6744 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.069 |
| InChI Key: | JSHBPKQGZWWEKB-UHFFFAOYSA-N |