5-[(2-methylphenoxy)methyl]-2-[(morpholin-4-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-[(2-methylphenoxy)methyl]-2-[(morpholin-4-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-[(2-methylphenoxy)methyl]-2-[(morpholin-4-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8016-3004 |
| Compound Name: | 5-[(2-methylphenoxy)methyl]-2-[(morpholin-4-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C21 H24 N4 O2 S |
| Smiles: | Cc1ccccc1OCC1=NN(CN2CCOCC2)C(N1c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.1568 |
| logD: | 2.7205 |
| logSw: | -3.11 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.003 |
| InChI Key: | XIEYTUNEYIIGHQ-UHFFFAOYSA-N |