[4-(2-fluorophenyl)piperazin-1-yl][2-({[4-(1-methoxypropan-2-yl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
[4-(2-fluorophenyl)piperazin-1-yl][2-({[4-(1-methoxypropan-2-yl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
[4-(2-fluorophenyl)piperazin-1-yl][2-({[4-(1-methoxypropan-2-yl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V029-5031 |
| Compound Name: | [4-(2-fluorophenyl)piperazin-1-yl][2-({[4-(1-methoxypropan-2-yl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 559.71 |
| Molecular Formula: | C31 H34 F N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(COC)n1c(c2ccc(C)cc2)nnc1SCc1ccccc1C(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7069 |
| logD: | 5.7069 |
| logSw: | -5.4897 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.932 |
| InChI Key: | CAUARQTYQFCQIT-QHCPKHFHSA-N |