3-(1,3-benzothiazol-2-yl)-1-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
3-(1,3-benzothiazol-2-yl)-1-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one
Compound characteristics
| Compound ID: | S511-1077 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}propan-1-one |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C25 H33 N3 O3 S |
| Smiles: | C1CCN(C1)C(CC1CCOC2(CCN(CC2)C(CCc2nc3ccccc3s2)=O)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3044 |
| logD: | 3.3044 |
| logSw: | -3.4809 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.664 |
| InChI Key: | DSMZZSKIDIYSEX-IBGZPJMESA-N |