4-[rel-(3R,4R)-1-acetyl-4-(phenoxymethyl)pyrrolidin-3-yl]-N-cyclohexylpiperidine-1-carboxamide
Chemical Structure Depiction of
4-[rel-(3R,4R)-1-acetyl-4-(phenoxymethyl)pyrrolidin-3-yl]-N-cyclohexylpiperidine-1-carboxamide
4-[rel-(3R,4R)-1-acetyl-4-(phenoxymethyl)pyrrolidin-3-yl]-N-cyclohexylpiperidine-1-carboxamide
Compound characteristics
| Compound ID: | S995-0011 |
| Compound Name: | 4-[rel-(3R,4R)-1-acetyl-4-(phenoxymethyl)pyrrolidin-3-yl]-N-cyclohexylpiperidine-1-carboxamide |
| Molecular Weight: | 427.59 |
| Molecular Formula: | C25 H37 N3 O3 |
| Smiles: | CC(N1C[C@@H](COc2ccccc2)[C@@H](C1)C1CCN(CC1)C(NC1CCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.1331 |
| logD: | 4.1331 |
| logSw: | -4.0087 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.332 |
| InChI Key: | GHXUTTRMXKOCST-ZJSXRUAMSA-N |