(4-ethylpiperazin-1-yl)[2-({[5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Chemical Structure Depiction of
(4-ethylpiperazin-1-yl)[2-({[5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
(4-ethylpiperazin-1-yl)[2-({[5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone
Compound characteristics
| Compound ID: | V026-7499 |
| Compound Name: | (4-ethylpiperazin-1-yl)[2-({[5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl]methanone |
| Molecular Weight: | 487.62 |
| Molecular Formula: | C27 H29 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1CSc1nnc(c2ccco2)n1c1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1308 |
| logD: | 3.9546 |
| logSw: | -4.0983 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.175 |
| InChI Key: | NMQLZOARRXJRBS-UHFFFAOYSA-N |