rel-(1R,2R,3R)-3-(4-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a]pyrazole-1,2-dicarbonitrile
Chemical Structure Depiction of
rel-(1R,2R,3R)-3-(4-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a]pyrazole-1,2-dicarbonitrile
rel-(1R,2R,3R)-3-(4-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a]pyrazole-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8010-6464 |
| Compound Name: | rel-(1R,2R,3R)-3-(4-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a]pyrazole-1,2-dicarbonitrile |
| Molecular Weight: | 268.32 |
| Molecular Formula: | C15 H16 N4 O |
| Smiles: | COc1ccc(cc1)[C@H]1[C@@H](C#N)[C@H](C#N)N2CCCN12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3635 |
| logD: | 1.3635 |
| logSw: | -1.6326 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.429 |
| InChI Key: | KRVXHTQCDABARS-QLFBSQMISA-N |