[3-({[4-(2-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[3-({[4-(2-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[3-({[4-(2-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V029-8442 |
| Compound Name: | [3-({[4-(2-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 489.66 |
| Molecular Formula: | C26 H27 N5 O S2 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c(c2cccs2)nnc1SCc1cccc(c1)C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1295 |
| logD: | 3.9988 |
| logSw: | -4.2527 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.555 |
| InChI Key: | VECBOROVPCQBFF-UHFFFAOYSA-N |