N-{4-[3-(2-ethoxyethoxy)-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide
Chemical Structure Depiction of
N-{4-[3-(2-ethoxyethoxy)-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide
N-{4-[3-(2-ethoxyethoxy)-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide
Compound characteristics
| Compound ID: | V024-9379 |
| Compound Name: | N-{4-[3-(2-ethoxyethoxy)-5-(3-methoxyphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide |
| Molecular Weight: | 490.53 |
| Molecular Formula: | C27 H27 F N4 O4 |
| Salt: | not_available |
| Smiles: | CCOCCOc1nc(c2cccc(c2)OC)n(c2ccc(cc2)NC(c2ccc(c(C)c2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3723 |
| logD: | 5.3696 |
| logSw: | -5.4033 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.72 |
| InChI Key: | XHFQIFUNNMUOFT-UHFFFAOYSA-N |