[4-({[5-(2-chlorophenyl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[4-({[5-(2-chlorophenyl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[4-({[5-(2-chlorophenyl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V029-5050 |
| Compound Name: | [4-({[5-(2-chlorophenyl)-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 486.04 |
| Molecular Formula: | C24 H28 Cl N5 O2 S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)C(c1ccc(CSc2nnc(c3ccccc3[Cl])n2CCOC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.689 |
| logD: | 2.5583 |
| logSw: | -3.6292 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.687 |
| InChI Key: | IJFHPKWZZQXULY-UHFFFAOYSA-N |