3-[4-(cyclopentyloxy)phenyl]-5-{[(3-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[4-(cyclopentyloxy)phenyl]-5-{[(3-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-[4-(cyclopentyloxy)phenyl]-5-{[(3-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-6310 |
| Compound Name: | 3-[4-(cyclopentyloxy)phenyl]-5-{[(3-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 405.56 |
| Molecular Formula: | C24 H27 N3 O S |
| Smiles: | Cc1cccc(CSc2nnc(c3ccc(cc3)OC3CCCC3)n2CC=C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.3302 |
| logD: | 6.3302 |
| logSw: | -5.5952 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.0389 |
| InChI Key: | UDUNVVJPDWXBDZ-UHFFFAOYSA-N |