5-(5-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(5-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
5-(5-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
Compound ID: | Y500-8477 |
Compound Name: | 5-(5-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol |
Molecular Weight: | 369.48 |
Molecular Formula: | C20 H23 N3 O2 S |
Smiles: | CC(C)Cn1c(c2ccc(COc3ccc4CCCc4c3)o2)nnc1S |
Stereo: | ACHIRAL |
logP: | 4.9052 |
logD: | 4.7974 |
logSw: | -4.6343 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.341 |
InChI Key: | CULDTNHLNHFZJB-UHFFFAOYSA-N |