1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]-2-(4-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-(4-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-(4-methyl-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | SA52-1175 |
| Compound Name: | 1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]-2-(4-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(Cn1cc(C)cn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4113 |
| logD: | 1.3921 |
| logSw: | -1.3698 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.363 |
| InChI Key: | PHXCQEKPQSLYQQ-INIZCTEOSA-N |