[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl](pyridin-4-yl)methanone
Chemical Structure Depiction of
[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl](pyridin-4-yl)methanone
[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl](pyridin-4-yl)methanone
Compound characteristics
| Compound ID: | S895-1218 |
| Compound Name: | [3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl](pyridin-4-yl)methanone |
| Molecular Weight: | 353.47 |
| Molecular Formula: | C20 H27 N5 O |
| Smiles: | CC(C)c1nnc2CCC3(CCN(CC3)C(c3ccncc3)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 1.0901 |
| logD: | 1.0704 |
| logSw: | -1.2621 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.339 |
| InChI Key: | LCMUQQPPOVPBMS-UHFFFAOYSA-N |