N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-fluorobenzamide
N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V003-5966 |
| Compound Name: | N-{3-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-fluorobenzamide |
| Molecular Weight: | 408.45 |
| Molecular Formula: | C21 H17 F N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccs2)n(c2cccc(c2)NC(c2cccc(c2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2302 |
| logD: | 5.2301 |
| logSw: | -5.0234 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.923 |
| InChI Key: | MZBDNJCPSHAYDL-UHFFFAOYSA-N |