2-(1-ethylpiperidin-4-yl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(1-ethylpiperidin-4-yl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
2-(1-ethylpiperidin-4-yl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0492 |
| Compound Name: | 2-(1-ethylpiperidin-4-yl)-1-[4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C18 H31 N5 O4 S |
| Smiles: | CCN1CCC(CC1)CC(N1CCC(c2nc(C)no2)N(CC1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7608 |
| logD: | -1.3011 |
| logSw: | -1.5146 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.463 |
| InChI Key: | BRTODNRDAKSFQE-INIZCTEOSA-N |