3'-(methoxymethyl)-1-[(thiophen-3-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-[(thiophen-3-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
3'-(methoxymethyl)-1-[(thiophen-3-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-0254 |
| Compound Name: | 3'-(methoxymethyl)-1-[(thiophen-3-yl)methyl]-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 346.49 |
| Molecular Formula: | C18 H26 N4 O S |
| Smiles: | COCc1nnc2CCC3(CCN(CC3)Cc3ccsc3)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 1.4517 |
| logD: | 0.2734 |
| logSw: | -2.0521 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.414 |
| InChI Key: | HKFSTELBOGYJEW-UHFFFAOYSA-N |