1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(3-chloro-1,2-oxazol-5-yl)propan-1-one
Chemical Structure Depiction of
1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(3-chloro-1,2-oxazol-5-yl)propan-1-one
1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(3-chloro-1,2-oxazol-5-yl)propan-1-one
Compound characteristics
| Compound ID: | T501-1341 |
| Compound Name: | 1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(3-chloro-1,2-oxazol-5-yl)propan-1-one |
| Molecular Weight: | 413.91 |
| Molecular Formula: | C21 H24 Cl N5 O2 |
| Smiles: | C1CC(Cc2nncn2Cc2ccccc2)CN(C1)C(CCc1cc(no1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6104 |
| logD: | 2.6104 |
| logSw: | -3.0689 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.198 |
| InChI Key: | RRHXSRVQHLHJOL-QGZVFWFLSA-N |