2-methyl-1-(4-{rel-(3R,4R)-4-(phenoxymethyl)-1-[(1H-pyrazol-1-yl)acetyl]pyrrolidin-3-yl}piperidin-1-yl)propan-1-one
Chemical Structure Depiction of
2-methyl-1-(4-{rel-(3R,4R)-4-(phenoxymethyl)-1-[(1H-pyrazol-1-yl)acetyl]pyrrolidin-3-yl}piperidin-1-yl)propan-1-one
2-methyl-1-(4-{rel-(3R,4R)-4-(phenoxymethyl)-1-[(1H-pyrazol-1-yl)acetyl]pyrrolidin-3-yl}piperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S995-0378 |
| Compound Name: | 2-methyl-1-(4-{rel-(3R,4R)-4-(phenoxymethyl)-1-[(1H-pyrazol-1-yl)acetyl]pyrrolidin-3-yl}piperidin-1-yl)propan-1-one |
| Molecular Weight: | 438.57 |
| Molecular Formula: | C25 H34 N4 O3 |
| Smiles: | CC(C)C(N1CCC(CC1)[C@@H]1CN(C[C@H]1COc1ccccc1)C(Cn1cccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.6532 |
| logD: | 2.6532 |
| logSw: | -2.7465 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.263 |
| InChI Key: | ZZJCJUJUOGHLIQ-FYYLOGMGSA-N |