2-(4-methyl-1H-pyrazol-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-(4-methyl-1H-pyrazol-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-(4-methyl-1H-pyrazol-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: | SC40-0205 |
| Compound Name: | 2-(4-methyl-1H-pyrazol-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: | 430.51 |
| Molecular Formula: | C21 H30 N6 O4 |
| Smiles: | Cc1cnn(CC(N2CCC3(CC2)Cn2c(CO3)c(COCC3CCCO3)nn2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.5311 |
| logD: | -0.5311 |
| logSw: | 0.1026 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.798 |
| InChI Key: | JVRQINQYTGHRTF-QGZVFWFLSA-N |