rel-(3R,4S)-3-methoxy-1-(propan-2-yl)-4-(1-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)azetidin-2-one
Chemical Structure Depiction of
rel-(3R,4S)-3-methoxy-1-(propan-2-yl)-4-(1-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)azetidin-2-one
rel-(3R,4S)-3-methoxy-1-(propan-2-yl)-4-(1-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)azetidin-2-one
Compound characteristics
| Compound ID: | S743-0185 |
| Compound Name: | rel-(3R,4S)-3-methoxy-1-(propan-2-yl)-4-(1-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)azetidin-2-one |
| Molecular Weight: | 388.53 |
| Molecular Formula: | C20 H28 N4 O2 S |
| Smiles: | CC(C)N1C([C@@H]([C@@H]1C1CCN(CC1)Cc1c[nH]nc1c1cccs1)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3374 |
| logD: | -0.905 |
| logSw: | -2.6664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.131 |
| InChI Key: | SOEYHNTYZRWXPC-RTBURBONSA-N |