1-[4-benzoyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-benzoyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethan-1-one
1-[4-benzoyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | S990-0792 |
| Compound Name: | 1-[4-benzoyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethan-1-one |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C22 H25 N5 O4 |
| Smiles: | Cc1c(CC(N2CCC(c3nc(C)no3)N(CC2)C(c2ccccc2)=O)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9115 |
| logD: | 1.9115 |
| logSw: | -2.0883 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 86.169 |
| InChI Key: | SZODAWACOPWYOP-IBGZPJMESA-N |