[4-({[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[4-({[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[4-({[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V025-3760 |
| Compound Name: | [4-({[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C27 H28 N6 O2 S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)C(c1ccc(CSc2nnc(c3ccncc3)n2c2ccc(cc2)OC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5756 |
| logD: | 2.4449 |
| logSw: | -2.4775 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.809 |
| InChI Key: | MPJOSOVSQAEMOZ-UHFFFAOYSA-N |