4-[(2S,4S)-2-(morpholine-4-carbonyl)-4-phenoxypyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[(2S,4S)-2-(morpholine-4-carbonyl)-4-phenoxypyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[(2S,4S)-2-(morpholine-4-carbonyl)-4-phenoxypyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S943-0423 |
| Compound Name: | 4-[(2S,4S)-2-(morpholine-4-carbonyl)-4-phenoxypyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 445.44 |
| Molecular Formula: | C23 H22 F3 N3 O3 |
| Smiles: | C1[C@@H](C(N2CCOCC2)=O)N(C[C@H]1Oc1ccccc1)c1ccc(C#N)c(c1)C(F)(F)F |
| Stereo: | ABSOLUTE |
| logP: | 3.2093 |
| logD: | 3.2093 |
| logSw: | -3.4839 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.559 |
| InChI Key: | LDKJWVUBTWDHSI-CTNGQTDRSA-N |