[rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](1-methyl-1H-pyrazol-4-yl)methanone
Chemical Structure Depiction of
[rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](1-methyl-1H-pyrazol-4-yl)methanone
[rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](1-methyl-1H-pyrazol-4-yl)methanone
Compound characteristics
| Compound ID: | S616-0121 |
| Compound Name: | [rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](1-methyl-1H-pyrazol-4-yl)methanone |
| Molecular Weight: | 310.4 |
| Molecular Formula: | C18 H22 N4 O |
| Smiles: | Cn1cc(cn1)C(N1CC[C@@H]2CN(Cc3ccccc3)[C@@H]2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1049 |
| logD: | -0.3771 |
| logSw: | -1.6242 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.81 |
| InChI Key: | YBRZIMJUURKGHX-RDJZCZTQSA-N |