1-(2,4-difluorobenzene-1-sulfonyl)-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Chemical Structure Depiction of
1-(2,4-difluorobenzene-1-sulfonyl)-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
1-(2,4-difluorobenzene-1-sulfonyl)-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-0263 |
| Compound Name: | 1-(2,4-difluorobenzene-1-sulfonyl)-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 426.48 |
| Molecular Formula: | C19 H24 F2 N4 O3 S |
| Smiles: | COCc1nnc2CCC3(CCN(CC3)S(c3ccc(cc3F)F)(=O)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 1.5286 |
| logD: | 1.5284 |
| logSw: | -2.2713 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.374 |
| InChI Key: | MWMJPDRYWMSVJW-UHFFFAOYSA-N |