5-(phenoxymethyl)-4-phenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(phenoxymethyl)-4-phenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(phenoxymethyl)-4-phenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8017-4913 |
| Compound Name: | 5-(phenoxymethyl)-4-phenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C26 H26 N4 O S |
| Smiles: | C1CN(CC1c1ccccc1)CN1C(N(C(COc2ccccc2)=N1)c1ccccc1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0563 |
| logD: | 2.5487 |
| logSw: | -4.7814 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.036 |
| InChI Key: | KXMAZWIKBGZDDL-JOCHJYFZSA-N |