5-(3-methoxyphenyl)-4-methyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(3-methoxyphenyl)-4-methyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(3-methoxyphenyl)-4-methyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8008-5012 |
| Compound Name: | 5-(3-methoxyphenyl)-4-methyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 304.41 |
| Molecular Formula: | C15 H20 N4 O S |
| Smiles: | CN1C(c2cccc(c2)OC)=NN(CN2CCCC2)C1=S |
| Stereo: | ACHIRAL |
| logP: | 2.5159 |
| logD: | -0.4751 |
| logSw: | -2.5317 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.212 |
| InChI Key: | JHNKOFVWVCNMDW-UHFFFAOYSA-N |