1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-4-phenylbutan-1-one
Chemical Structure Depiction of
1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-4-phenylbutan-1-one
1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-4-phenylbutan-1-one
Compound characteristics
| Compound ID: | S990-0540 |
| Compound Name: | 1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-4-phenylbutan-1-one |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C20 H26 N4 O3 |
| Smiles: | CC(N1CCN(CCC1c1nc(C)no1)C(CCCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1894 |
| logD: | 2.1894 |
| logSw: | -2.2168 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.87 |
| InChI Key: | VDEBFSSBWRRMLD-GOSISDBHSA-N |