2-(azepan-1-yl)-1-(3'-{[(oxolan-2-yl)methoxy]methyl}-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-(3'-{[(oxolan-2-yl)methoxy]methyl}-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl)ethan-1-one
2-(azepan-1-yl)-1-(3'-{[(oxolan-2-yl)methoxy]methyl}-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | SC40-0210 |
| Compound Name: | 2-(azepan-1-yl)-1-(3'-{[(oxolan-2-yl)methoxy]methyl}-4'H,7'H-spiro[piperidine-4,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-1-yl)ethan-1-one |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C23 H37 N5 O4 |
| Smiles: | C1CCCN(CC1)CC(N1CCC2(CC1)Cn1c(CO2)c(COCC2CCCO2)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3763 |
| logD: | -0.1964 |
| logSw: | -0.4424 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.356 |
| InChI Key: | JIHOFCZXFYOKNP-LJQANCHMSA-N |