3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
Chemical Structure Depiction of
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | S517-1115 |
| Compound Name: | 3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}propan-1-one |
| Molecular Weight: | 472.55 |
| Molecular Formula: | C26 H28 N6 O3 |
| Smiles: | COc1ccccc1c1nc(CCC(N2CCC(CC2)Cc2nncn2c2ccccc2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.3276 |
| logD: | 3.3273 |
| logSw: | -3.8005 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.853 |
| InChI Key: | BPNWPDXBOAFJGR-UHFFFAOYSA-N |