[rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](3-fluoro-4-methoxyphenyl)methanone
Chemical Structure Depiction of
[rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](3-fluoro-4-methoxyphenyl)methanone
[rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](3-fluoro-4-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | S616-0039 |
| Compound Name: | [rel-(1R,6S)-8-benzyl-3,8-diazabicyclo[4.2.0]octan-3-yl](3-fluoro-4-methoxyphenyl)methanone |
| Molecular Weight: | 354.42 |
| Molecular Formula: | C21 H23 F N2 O2 |
| Smiles: | COc1ccc(cc1F)C(N1CC[C@@H]2CN(Cc3ccccc3)[C@@H]2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8337 |
| logD: | 1.3517 |
| logSw: | -3.2185 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.6312 |
| InChI Key: | GIHCQZVJGWAZMI-HKUYNNGSSA-N |