1-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]anilino}-3-(2-methylpropoxy)propan-2-ol
Chemical Structure Depiction of
1-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]anilino}-3-(2-methylpropoxy)propan-2-ol
1-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]anilino}-3-(2-methylpropoxy)propan-2-ol
Compound characteristics
| Compound ID: | V002-2586 |
| Compound Name: | 1-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]anilino}-3-(2-methylpropoxy)propan-2-ol |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C25 H33 F N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)COCC(CNc1ccc(cc1)n1c(c2ccccc2F)nc(n1)OCC(C)C)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2264 |
| logD: | 5.2262 |
| logSw: | -5.0607 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.749 |
| InChI Key: | AOXRULTVYSLHHW-NRFANRHFSA-N |