3'-(2-methoxyethyl)-1-(pyridine-3-sulfonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Chemical Structure Depiction of
3'-(2-methoxyethyl)-1-(pyridine-3-sulfonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
3'-(2-methoxyethyl)-1-(pyridine-3-sulfonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-0975 |
| Compound Name: | 3'-(2-methoxyethyl)-1-(pyridine-3-sulfonyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C19 H27 N5 O3 S |
| Smiles: | COCCc1nnc2CCC3(CCN(CC3)S(c3cccnc3)(=O)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 0.5912 |
| logD: | 0.5908 |
| logSw: | -1.5048 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.81 |
| InChI Key: | CARMBSMAHNGKAH-UHFFFAOYSA-N |