5-{5-[(2-methoxyphenoxy)methyl]furan-2-yl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-{5-[(2-methoxyphenoxy)methyl]furan-2-yl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol
5-{5-[(2-methoxyphenoxy)methyl]furan-2-yl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-5662 |
| Compound Name: | 5-{5-[(2-methoxyphenoxy)methyl]furan-2-yl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C21 H26 N4 O4 S |
| Smiles: | COc1ccccc1OCc1ccc(c2nnc(n2CCCN2CCOCC2)S)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.2885 |
| logD: | 2.0055 |
| logSw: | -2.2742 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.37 |
| InChI Key: | GRUVAYIWDZGYBW-UHFFFAOYSA-N |