N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-3,4-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-3,4-dimethoxybenzene-1-sulfonamide
N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-3,4-dimethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-1074 |
| Compound Name: | N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-3,4-dimethoxybenzene-1-sulfonamide |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C19 H21 F N4 O4 S |
| Smiles: | COc1ccc(cc1OC)S(NCCc1nc(Cc2ccc(cc2)F)[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6869 |
| logD: | 2.6855 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.865 |
| InChI Key: | BBWPQGXUDQPBTF-UHFFFAOYSA-N |