2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-[4-(1H-1,2,4-triazol-3-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-[4-(1H-1,2,4-triazol-3-yl)phenyl]acetamide
2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-[4-(1H-1,2,4-triazol-3-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | Y044-4941 |
| Compound Name: | 2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-[4-(1H-1,2,4-triazol-3-yl)phenyl]acetamide |
| Molecular Weight: | 351.41 |
| Molecular Formula: | C19 H21 N5 O2 |
| Smiles: | C1COCCC1(CC(Nc1ccc(cc1)c1nc[nH]n1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0542 |
| logD: | 2.0473 |
| logSw: | -2.621 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.223 |
| InChI Key: | RMZAIMOEDVBTAC-UHFFFAOYSA-N |