(2,4-dimethyl-1,3-thiazol-5-yl)[3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone
Chemical Structure Depiction of
(2,4-dimethyl-1,3-thiazol-5-yl)[3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone
(2,4-dimethyl-1,3-thiazol-5-yl)[3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone
Compound characteristics
| Compound ID: | S895-0992 |
| Compound Name: | (2,4-dimethyl-1,3-thiazol-5-yl)[3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-1-yl]methanone |
| Molecular Weight: | 403.55 |
| Molecular Formula: | C20 H29 N5 O2 S |
| Smiles: | Cc1c(C(N2CCC3(CCc4nnc(CCOC)n4CC3)CC2)=O)sc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.2165 |
| logD: | 1.2162 |
| logSw: | -1.5298 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.618 |
| InChI Key: | HREVEOLNKZYGHZ-UHFFFAOYSA-N |