1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]-2-(3-methyl-1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]-2-(3-methyl-1H-pyrazol-1-yl)ethan-1-one
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]-2-(3-methyl-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | SA52-0218 |
| Compound Name: | 1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]-2-(3-methyl-1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 360.46 |
| Molecular Formula: | C18 H28 N6 O2 |
| Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)C(Cn1ccc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1075 |
| logD: | 1.0883 |
| logSw: | -1.8365 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.052 |
| InChI Key: | RAVBPUYNMAEDHH-INIZCTEOSA-N |