1-(4-methylphenyl)-5-propyl-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
1-(4-methylphenyl)-5-propyl-1,3,5-triazinane-2-thione
1-(4-methylphenyl)-5-propyl-1,3,5-triazinane-2-thione
Compound characteristics
Compound ID: | 5701-2512 |
Compound Name: | 1-(4-methylphenyl)-5-propyl-1,3,5-triazinane-2-thione |
Molecular Weight: | 249.38 |
Molecular Formula: | C13 H19 N3 S |
Smiles: | CCCN1CNC(N(C1)c1ccc(C)cc1)=S |
Stereo: | ACHIRAL |
logP: | 3.1977 |
logD: | 2.496 |
logSw: | -3.0396 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 18.1823 |
InChI Key: | LQMUXTUAXTZHCW-UHFFFAOYSA-N |