3-[3-(azepan-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-[3-(azepan-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
3-[3-(azepan-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E883-0012 |
| Compound Name: | 3-[3-(azepan-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 335.42 |
| Molecular Formula: | C16 H21 N3 O3 S |
| Smiles: | C1CCCN(CC1)C(CCC1NS(c2ccccc2N=1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1332 |
| logD: | 1.1332 |
| logSw: | -2.2803 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.348 |
| InChI Key: | LCPNSUZAGQBKDZ-UHFFFAOYSA-N |