2-({5-[4-(decyloxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(9H-fluoren-2-yl)ethan-1-one
Chemical Structure Depiction of
2-({5-[4-(decyloxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(9H-fluoren-2-yl)ethan-1-one
2-({5-[4-(decyloxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(9H-fluoren-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8008-6409 |
| Compound Name: | 2-({5-[4-(decyloxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(9H-fluoren-2-yl)ethan-1-one |
| Molecular Weight: | 579.81 |
| Molecular Formula: | C36 H41 N3 O2 S |
| Smiles: | CCCCCCCCCCOc1ccc(cc1)c1nnc(n1CC=C)SCC(c1ccc2c(Cc3ccccc23)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 10.946 |
| logD: | 10.946 |
| logSw: | -5.6945 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.899 |
| InChI Key: | AYUKRLIAHUVWPJ-UHFFFAOYSA-N |