(3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(4-methyl-1,3-oxazol-5-yl)methanone
Chemical Structure Depiction of
(3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(4-methyl-1,3-oxazol-5-yl)methanone
(3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(4-methyl-1,3-oxazol-5-yl)methanone
Compound characteristics
| Compound ID: | S895-0796 |
| Compound Name: | (3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(4-methyl-1,3-oxazol-5-yl)methanone |
| Molecular Weight: | 343.43 |
| Molecular Formula: | C18 H25 N5 O2 |
| Smiles: | CCc1nnc2CCC3(CCN(CC3)C(c3c(C)nco3)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 0.5938 |
| logD: | 0.5877 |
| logSw: | -0.8334 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.801 |
| InChI Key: | USFKGPBCRPACHD-UHFFFAOYSA-N |