3,4-dichloro-N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
Chemical Structure Depiction of
3,4-dichloro-N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
3,4-dichloro-N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | V017-2879 |
| Compound Name: | 3,4-dichloro-N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}benzamide |
| Molecular Weight: | 499.37 |
| Molecular Formula: | C25 H21 Cl2 F N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2ccccc2F)n(c2ccc(cc2)NC(c2ccc(c(c2)[Cl])[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.0845 |
| logD: | 7.0783 |
| logSw: | -6.3606 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.28 |
| InChI Key: | LGPOOFDCBMCGDU-UHFFFAOYSA-N |