3-(1H-benzimidazol-2-yl)-1-(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)propan-1-one
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-1-(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)propan-1-one
3-(1H-benzimidazol-2-yl)-1-(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)propan-1-one
Compound characteristics
| Compound ID: | S726-1628 |
| Compound Name: | 3-(1H-benzimidazol-2-yl)-1-(4-{2-[(pyridin-3-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)propan-1-one |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C26 H32 N4 O3 |
| Smiles: | C(COc1cccnc1)C1CCOC2(CCN(CC2)C(CCc2nc3ccccc3[nH]2)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2056 |
| logD: | 3.138 |
| logSw: | -3.0547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.907 |
| InChI Key: | RFNFWHIXQXKZDW-HXUWFJFHSA-N |