3-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
3-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzonitrile
3-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | S720-0755 |
| Compound Name: | 3-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzonitrile |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C23 H23 N3 O3 |
| Smiles: | C1CCN(C1)C([C@@H]1C[C@@H](CN1C(c1cccc(C#N)c1)=O)Oc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7521 |
| logD: | 2.7521 |
| logSw: | -3.0803 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.212 |
| InChI Key: | ZCZVRDGOQVJZKC-RTWAWAEBSA-N |