3'-(methoxymethyl)-1-[(5-methylfuran-2-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Chemical Structure Depiction of
3'-(methoxymethyl)-1-[(5-methylfuran-2-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
3'-(methoxymethyl)-1-[(5-methylfuran-2-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-0234 |
| Compound Name: | 3'-(methoxymethyl)-1-[(5-methylfuran-2-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 344.46 |
| Molecular Formula: | C19 H28 N4 O2 |
| Smiles: | Cc1ccc(CN2CCC3(CCc4nnc(COC)n4CC3)CC2)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.4979 |
| logD: | 0.6669 |
| logSw: | -1.7665 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.658 |
| InChI Key: | JRIFQFWVJVPVAY-UHFFFAOYSA-N |