3-[(3-methylphenoxy)methyl]-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-[(3-methylphenoxy)methyl]-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[(3-methylphenoxy)methyl]-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D228-0330 |
| Compound Name: | 3-[(3-methylphenoxy)methyl]-6-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C19 H18 N4 O S2 |
| Smiles: | Cc1cccc(c1)OCc1nnc2n1nc(c1csc3CCCCc13)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.5696 |
| logD: | 4.5696 |
| logSw: | -4.5305 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.136 |
| InChI Key: | YECXWDRTYBQBRM-UHFFFAOYSA-N |