N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide
Compound characteristics
| Compound ID: | K261-2407 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C23 H25 N3 O5 S |
| Smiles: | C1CCC(C1)(CC1NS(c2ccccc2N=1)(=O)=O)CC(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3673 |
| logD: | 1.7929 |
| logSw: | -2.9742 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.498 |
| InChI Key: | WYOUAUITFMLDCO-UHFFFAOYSA-N |