5-({[5-benzyl-4-(3,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-benzyl-4-(3,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole
5-({[5-benzyl-4-(3,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D141-0088 |
| Compound Name: | 5-({[5-benzyl-4-(3,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C27 H25 N5 O2 S |
| Smiles: | Cc1ccc(cc1C)n1c(Cc2ccccc2)nnc1SCc1nc(c2ccccc2OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 6.2046 |
| logD: | 6.2046 |
| logSw: | -5.691 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.662 |
| InChI Key: | IYDYBZQFROQQQR-UHFFFAOYSA-N |