9-(2,1,3-benzothiadiazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane
Chemical Structure Depiction of
9-(2,1,3-benzothiadiazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane
9-(2,1,3-benzothiadiazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane
Compound characteristics
| Compound ID: | S726-1448 |
| Compound Name: | 9-(2,1,3-benzothiadiazole-4-sulfonyl)-4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecane |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C22 H26 N4 O4 S2 |
| Smiles: | C(COc1ccncc1)C1CCOC2(CCN(CC2)S(c2cccc3c2nsn3)(=O)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3221 |
| logD: | 3.3218 |
| logSw: | -3.415 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.078 |
| InChI Key: | TTXIUURFNFWEDL-QGZVFWFLSA-N |