3-[4-(cyclopentyloxy)phenyl]-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[4-(cyclopentyloxy)phenyl]-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-[4-(cyclopentyloxy)phenyl]-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8736 |
| Compound Name: | 3-[4-(cyclopentyloxy)phenyl]-5-{[(4-fluorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 409.52 |
| Molecular Formula: | C23 H24 F N3 O S |
| Smiles: | C=CCn1c(c2ccc(cc2)OC2CCCC2)nnc1SCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.4352 |
| logD: | 5.4352 |
| logSw: | -5.8167 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.0389 |
| InChI Key: | XQUCIEUDODLCCL-UHFFFAOYSA-N |