5-(5-chloro-2-methoxyphenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(5-chloro-2-methoxyphenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(5-chloro-2-methoxyphenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
Compound ID: | 4670-0176 |
Compound Name: | 5-(5-chloro-2-methoxyphenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
Molecular Weight: | 255.72 |
Molecular Formula: | C10 H10 Cl N3 O S |
Smiles: | CN1C(c2cc(ccc2OC)[Cl])=NNC1=S |
Stereo: | ACHIRAL |
logP: | 2.6176 |
logD: | 1.8571 |
logSw: | -3.6219 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 35.252 |
InChI Key: | VHILZAPMAFFGCD-UHFFFAOYSA-N |