N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide
Compound characteristics
| Compound ID: | K261-0711 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C25 H31 N3 O5 S |
| Smiles: | COc1ccc(CCNC(CC2(CCCC2)CC2NS(c3ccccc3N=2)(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.746 |
| logD: | 1.1716 |
| logSw: | -2.655 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.485 |
| InChI Key: | PHONKOGCQYGWNC-UHFFFAOYSA-N |