N-{4-[3-(2-ethoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{4-[3-(2-ethoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide
N-{4-[3-(2-ethoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | V003-3950 |
| Compound Name: | N-{4-[3-(2-ethoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Salt: | not_available |
| Smiles: | CCOCCOc1nc(c2cccs2)n(c2ccc(cc2)NC(c2ccc(cc2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.605 |
| logD: | 4.6043 |
| logSw: | -4.326 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.195 |
| InChI Key: | TVLSRTSZXREFJR-UHFFFAOYSA-N |