(1-ethyl-1H-pyrazol-5-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Chemical Structure Depiction of
(1-ethyl-1H-pyrazol-5-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
(1-ethyl-1H-pyrazol-5-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone
Compound characteristics
| Compound ID: | S616-0618 |
| Compound Name: | (1-ethyl-1H-pyrazol-5-yl){rel-(1R,6S)-8-[(pyridin-4-yl)methyl]-3,8-diazabicyclo[4.2.0]octan-3-yl}methanone |
| Molecular Weight: | 325.41 |
| Molecular Formula: | C18 H23 N5 O |
| Smiles: | CCn1c(ccn1)C(N1CC[C@@H]2CN(Cc3ccncc3)[C@@H]2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3893 |
| logD: | -0.4308 |
| logSw: | -0.9754 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.518 |
| InChI Key: | BIQWHRXAAIGADZ-RDJZCZTQSA-N |