(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-N-(2-phenylethyl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-N-(2-phenylethyl)pyrrolidine-1-carboxamide
(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-N-(2-phenylethyl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB36-0652 |
| Compound Name: | (2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-N-(2-phenylethyl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 448.47 |
| Molecular Formula: | C21 H26 F2 N6 O3 |
| Smiles: | C(CNC(N1CC(C[C@H]1Cn1cc(C(N2CCOCC2)=O)nn1)(F)F)=O)c1ccccc1 |
| Stereo: | ABSOLUTE |
| logP: | 1.3078 |
| logD: | 1.3078 |
| logSw: | -1.8518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.887 |
| InChI Key: | IAFQMJBEBIOEJO-QGZVFWFLSA-N |