methyl 1-(6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxylate
Chemical Structure Depiction of
methyl 1-(6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxylate
methyl 1-(6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxylate
Compound characteristics
| Compound ID: | M494-0849 |
| Compound Name: | methyl 1-(6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxylate |
| Molecular Weight: | 438.51 |
| Molecular Formula: | C21 H22 N6 O3 S |
| Smiles: | COC(c1cn(cn1)c1ccc(nn1)SCC(N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0617 |
| logD: | 2.0617 |
| logSw: | -2.1394 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.599 |
| InChI Key: | UJYALOYYSKDJAS-UHFFFAOYSA-N |