3-(1,3-benzothiazol-2-yl)-1-[1-(pyrrolidine-1-carbonyl)-9-oxa-2-azaspiro[5.5]undecan-2-yl]propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-[1-(pyrrolidine-1-carbonyl)-9-oxa-2-azaspiro[5.5]undecan-2-yl]propan-1-one
3-(1,3-benzothiazol-2-yl)-1-[1-(pyrrolidine-1-carbonyl)-9-oxa-2-azaspiro[5.5]undecan-2-yl]propan-1-one
Compound characteristics
| Compound ID: | SB49-0762 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-[1-(pyrrolidine-1-carbonyl)-9-oxa-2-azaspiro[5.5]undecan-2-yl]propan-1-one |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C24 H31 N3 O3 S |
| Smiles: | C1CCN(C1)C(C1C2(CCCN1C(CCc1nc3ccccc3s1)=O)CCOCC2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.932 |
| logD: | 2.932 |
| logSw: | -3.1175 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.936 |
| InChI Key: | CSTJGAHYGHEUMY-JOCHJYFZSA-N |