1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(2-methylphenyl)ethan-1-one
1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S990-0577 |
| Compound Name: | 1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 356.42 |
| Molecular Formula: | C19 H24 N4 O3 |
| Smiles: | CC(N1CCN(CCC1c1nc(C)no1)C(Cc1ccccc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0564 |
| logD: | 2.0564 |
| logSw: | -2.0789 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.87 |
| InChI Key: | IQHZGMMYFXJTHU-QGZVFWFLSA-N |