4-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-sulfonyl]benzonitrile
Chemical Structure Depiction of
4-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-sulfonyl]benzonitrile
4-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-sulfonyl]benzonitrile
Compound characteristics
| Compound ID: | S720-0955 |
| Compound Name: | 4-[(2S,4S)-4-phenoxy-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-sulfonyl]benzonitrile |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | C1CCN(C1)C([C@@H]1C[C@@H](CN1S(c1ccc(C#N)cc1)(=O)=O)Oc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8588 |
| logD: | 2.8588 |
| logSw: | -3.3572 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.052 |
| InChI Key: | IZZNYGOXEBOMIS-CTNGQTDRSA-N |