[3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V030-1361 |
| Compound Name: | [3-({[4-(2-methoxyphenyl)-5-(pyridin-3-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(c1cccc(CSc2nnc(c3cccnc3)n2c2ccccc2OC)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3463 |
| logD: | 2.2156 |
| logSw: | -2.3746 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.685 |
| InChI Key: | OGWPKLQRSWCEHH-UHFFFAOYSA-N |