N-{4-[5-(2-fluorophenyl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{4-[5-(2-fluorophenyl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-nitrobenzamide
N-{4-[5-(2-fluorophenyl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | V025-5319 |
| Compound Name: | N-{4-[5-(2-fluorophenyl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-nitrobenzamide |
| Molecular Weight: | 477.45 |
| Molecular Formula: | C24 H20 F N5 O5 |
| Salt: | not_available |
| Smiles: | COCCOc1nc(c2ccccc2F)n(c2ccc(cc2)NC(c2ccc(cc2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8943 |
| logD: | 3.8941 |
| logSw: | -4.1027 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.923 |
| InChI Key: | JTIQZXGGZRUHBD-UHFFFAOYSA-N |