4-(azepane-1-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
4-(azepane-1-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
Compound characteristics
| Compound ID: | 3341-3948 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(cc1)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1931 |
| logD: | 3.1931 |
| logSw: | -3.4922 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.809 |
| InChI Key: | ZQJHRAQOJSEOPH-UHFFFAOYSA-N |