2-(4-bromophenyl)-1-{4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-bromophenyl)-1-{4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
2-(4-bromophenyl)-1-{4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S454-0151 |
| Compound Name: | 2-(4-bromophenyl)-1-{4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 431.29 |
| Molecular Formula: | C18 H19 Br N6 O2 |
| Smiles: | Cc1nc(c2cn(C3CCN(CC3)C(Cc3ccc(cc3)[Br])=O)nn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.5683 |
| logD: | 2.5683 |
| logSw: | -2.3993 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.656 |
| InChI Key: | FURFSSIMXMRAQD-UHFFFAOYSA-N |