2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]ethan-1-one
2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | SA52-1013 |
| Compound Name: | 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C21 H25 N7 O3 |
| Smiles: | Cc1cc(C)n(CC(N2CCCN(C(C2)c2nc(C)no2)C(c2cccnc2)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.2649 |
| logD: | -0.2649 |
| logSw: | -0.6358 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 87.589 |
| InChI Key: | PEZQPPQCPDOFPW-SFHVURJKSA-N |