3-(3-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
3-(3-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
Compound characteristics
Compound ID: | V011-9422 |
Compound Name: | 3-(3-methoxyphenyl)-4-(4-methylphenyl)-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole |
Molecular Weight: | 337.44 |
Molecular Formula: | C19 H19 N3 O S |
Smiles: | Cc1ccc(cc1)n1c(c2cccc(c2)OC)nnc1SCC=C |
Stereo: | ACHIRAL |
logP: | 5.0487 |
logD: | 5.0487 |
logSw: | -4.772 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 32.528 |
InChI Key: | RQGWGYPNZNVJPO-UHFFFAOYSA-N |