[2-({[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
[2-({[4-(2-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[2-({[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: | V030-1387 |
| Compound Name: | [2-({[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)nnc1SCc1ccccc1C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5569 |
| logD: | 4.4262 |
| logSw: | -4.4052 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.555 |
| InChI Key: | ZNZRWWVYTUQABJ-UHFFFAOYSA-N |