(2-methylfuran-3-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Chemical Structure Depiction of
(2-methylfuran-3-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
(2-methylfuran-3-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Compound characteristics
| Compound ID: | S616-8217 |
| Compound Name: | (2-methylfuran-3-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C18 H21 N3 O2 |
| Smiles: | Cc1c(cco1)C(N1CC[C@@H]2CN(Cc3ccncc3)[C@@H]2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.992 |
| logD: | 0.4358 |
| logSw: | -1.7152 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.662 |
| InChI Key: | QFWHPQOCTCCHTB-NVXWUHKLSA-N |