[2-({[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
[2-({[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[2-({[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: | V015-4830 |
| Compound Name: | [2-({[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(c1ccccc1CSc1nnc(c2ccncc2)n1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2108 |
| logD: | 3.0801 |
| logSw: | -3.3359 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.809 |
| InChI Key: | LGWICCBYBWBEMX-UHFFFAOYSA-N |