(3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(2-methylpyridin-3-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)(2-methylpyridin-3-yl)methanone
(3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(2-methylpyridin-3-yl)methanone
Compound characteristics
| Compound ID: | S895-0793 |
| Compound Name: | (3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl)(2-methylpyridin-3-yl)methanone |
| Molecular Weight: | 353.47 |
| Molecular Formula: | C20 H27 N5 O |
| Smiles: | CCc1nnc2CCC3(CCN(CC3)C(c3cccnc3C)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 1.1087 |
| logD: | 1.1026 |
| logSw: | -1.979 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.512 |
| InChI Key: | NXWNNXHONZOMQR-UHFFFAOYSA-N |