{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}{5-[(1H-1,2,4-triazol-1-yl)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}{5-[(1H-1,2,4-triazol-1-yl)methyl]furan-2-yl}methanone
{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}{5-[(1H-1,2,4-triazol-1-yl)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | S759-0384 |
| Compound Name: | {4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}{5-[(1H-1,2,4-triazol-1-yl)methyl]furan-2-yl}methanone |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C25 H31 N5 O3 |
| Smiles: | CC(C)N1C[C@@H]([C@@H]1C1CCN(CC1)C(c1ccc(Cn2cncn2)o1)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.1662 |
| logD: | -0.9765 |
| logSw: | -3.0524 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.476 |
| InChI Key: | DYVUSKKERJYVGK-BJKOFHAPSA-N |