[4-(2-fluorophenyl)piperazin-1-yl][4-({[4-(3-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
[4-(2-fluorophenyl)piperazin-1-yl][4-({[4-(3-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
[4-(2-fluorophenyl)piperazin-1-yl][4-({[4-(3-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V001-7705 |
| Compound Name: | [4-(2-fluorophenyl)piperazin-1-yl][4-({[4-(3-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 564.68 |
| Molecular Formula: | C32 H29 F N6 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccncc2)nnc1SCc1ccc(cc1)C(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0566 |
| logD: | 5.0566 |
| logSw: | -4.6685 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.748 |
| InChI Key: | XRKGXOGTWUWSGZ-UHFFFAOYSA-N |