cyclohexyl[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone
Chemical Structure Depiction of
cyclohexyl[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone
cyclohexyl[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone
Compound characteristics
| Compound ID: | S895-1119 |
| Compound Name: | cyclohexyl[3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone |
| Molecular Weight: | 358.53 |
| Molecular Formula: | C21 H34 N4 O |
| Smiles: | CC(C)c1nnc2CCC3(CCN(CC3)C(C3CCCCC3)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 2.9636 |
| logD: | 2.9438 |
| logSw: | -2.9354 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.103 |
| InChI Key: | HRBIOZZWZXFNBW-UHFFFAOYSA-N |