N-[5-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide
Chemical Structure Depiction of
N-[5-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide
N-[5-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide
Compound characteristics
| Compound ID: | Y043-5626 |
| Compound Name: | N-[5-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-2-[4-(1H-pyrrol-1-yl)oxan-4-yl]acetamide |
| Molecular Weight: | 403.84 |
| Molecular Formula: | C19 H19 Cl F N5 O2 |
| Smiles: | C1COCCC1(CC(Nc1nc(c2ccc(c(c2)[Cl])F)[nH]n1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.477 |
| logD: | 3.4388 |
| logSw: | -4.0088 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.71 |
| InChI Key: | VUUZMIPKOAEAOL-UHFFFAOYSA-N |