[4-(2-fluorophenyl)piperazin-1-yl][2-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
[4-(2-fluorophenyl)piperazin-1-yl][2-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
[4-(2-fluorophenyl)piperazin-1-yl][2-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V027-5055 |
| Compound Name: | [4-(2-fluorophenyl)piperazin-1-yl][2-({[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C27 H26 F N5 O2 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2ccco2)nnc1SCc1ccccc1C(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6764 |
| logD: | 4.6764 |
| logSw: | -4.6828 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.405 |
| InChI Key: | KFHGXIFCXFFQNU-UHFFFAOYSA-N |