2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}acetamide
Chemical Structure Depiction of
2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}acetamide
2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}acetamide
Compound characteristics
| Compound ID: | Y044-4543 |
| Compound Name: | 2-[4-(1H-pyrrol-1-yl)oxan-4-yl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}acetamide |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C20 H23 N5 O2 |
| Smiles: | C1COCCC1(CC(Nc1ccc(Cn2cncn2)cc1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6407 |
| logD: | 1.6407 |
| logSw: | -1.9745 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.768 |
| InChI Key: | QHKGZCNRNOZLKT-UHFFFAOYSA-N |