2'-(2-methoxyethyl)-1-(oxolane-2-carbonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one
Chemical Structure Depiction of
2'-(2-methoxyethyl)-1-(oxolane-2-carbonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one
2'-(2-methoxyethyl)-1-(oxolane-2-carbonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one
Compound characteristics
| Compound ID: | S626-0391 |
| Compound Name: | 2'-(2-methoxyethyl)-1-(oxolane-2-carbonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C19 H30 N4 O4 |
| Smiles: | COCCN1C(N2CCC3(CCC2=N1)CCN(CC3)C(C1CCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4503 |
| logD: | 0.4503 |
| logSw: | -0.3621 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.897 |
| InChI Key: | PPVXJOMWAYYOFU-HNNXBMFYSA-N |