4-ethyl-3-(4-ethyl-5-methylthiophen-3-yl)-5-{[(naphthalen-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-ethyl-3-(4-ethyl-5-methylthiophen-3-yl)-5-{[(naphthalen-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
4-ethyl-3-(4-ethyl-5-methylthiophen-3-yl)-5-{[(naphthalen-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8712 |
| Compound Name: | 4-ethyl-3-(4-ethyl-5-methylthiophen-3-yl)-5-{[(naphthalen-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 393.57 |
| Molecular Formula: | C22 H23 N3 S2 |
| Smiles: | CCc1c(csc1C)c1nnc(n1CC)SCc1cccc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 6.4653 |
| logD: | 6.4627 |
| logSw: | -6.7629 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7123 |
| InChI Key: | VMTGURSQSLVAFG-UHFFFAOYSA-N |