(2S,4S)-N-benzyl-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
(2S,4S)-N-benzyl-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide
(2S,4S)-N-benzyl-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB29-0106 |
| Compound Name: | (2S,4S)-N-benzyl-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 315.37 |
| Molecular Formula: | C16 H21 N5 O2 |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C(NCc2ccccc2)=O)OC)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 1.3582 |
| logD: | 1.3568 |
| logSw: | -1.6128 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.479 |
| InChI Key: | NRNIWPQAPBCUIH-KGLIPLIRSA-N |