1-[rel-(3aR,4R,6aS)-4-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,4R,6aS)-4-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[rel-(3aR,4R,6aS)-4-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S891-0258 |
| Compound Name: | 1-[rel-(3aR,4R,6aS)-4-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 275.35 |
| Molecular Formula: | C16 H21 N O3 |
| Smiles: | [H][C@@]12CC[C@H]([C@@]2([H])CN(C1)C(Cc1ccc(cc1)OC)=O)O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6414 |
| logD: | 1.6414 |
| logSw: | -1.8515 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.038 |
| InChI Key: | ZTHBEDGKFGSGGI-SNPRPXQTSA-N |