3-(2-methoxyphenyl)-1-[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]propan-1-one
Chemical Structure Depiction of
3-(2-methoxyphenyl)-1-[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]propan-1-one
3-(2-methoxyphenyl)-1-[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]propan-1-one
Compound characteristics
| Compound ID: | S895-1219 |
| Compound Name: | 3-(2-methoxyphenyl)-1-[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]propan-1-one |
| Molecular Weight: | 410.56 |
| Molecular Formula: | C24 H34 N4 O2 |
| Smiles: | CC(C)c1nnc2CCC3(CCN(CC3)C(CCc3ccccc3OC)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 2.9152 |
| logD: | 2.8955 |
| logSw: | -3.2324 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.014 |
| InChI Key: | KZJSTUAWZXBBPY-UHFFFAOYSA-N |