N-[rel-(3R,4S)-1-[(3-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
N-[rel-(3R,4S)-1-[(3-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Compound characteristics
| Compound ID: | S823-3027 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3-cyanophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C18 H23 N3 O2 |
| Smiles: | C1CC(C1)C(N[C@@H]1CN(Cc2cccc(C#N)c2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1435 |
| logD: | -0.8858 |
| logSw: | -1.7236 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.235 |
| InChI Key: | JZOCFYCJGCDQEZ-SJORKVTESA-N |