[2-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[2-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone
[2-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V029-7997 |
| Compound Name: | [2-({[5-benzyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-ethylpiperazin-1-yl)methanone |
| Molecular Weight: | 511.69 |
| Molecular Formula: | C30 H33 N5 O S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1CSc1nnc(Cc2ccccc2)n1c1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8142 |
| logD: | 4.638 |
| logSw: | -4.598 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.573 |
| InChI Key: | NPKZESZNNBIVSY-UHFFFAOYSA-N |