methyl 4-(2-{[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
methyl 4-(2-{[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | L383-0014 |
| Compound Name: | methyl 4-(2-{[6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C24 H25 N5 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(CSc1ccc(nn1)N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0966 |
| logD: | 4.0965 |
| logSw: | -4.1165 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.57 |
| InChI Key: | NLXTWFRHLIJMFJ-UHFFFAOYSA-N |