ethyl 2-(2-{[6-(5-methyl-1H-pyrazol-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 2-(2-{[6-(5-methyl-1H-pyrazol-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
ethyl 2-(2-{[6-(5-methyl-1H-pyrazol-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | M428-0522 |
| Compound Name: | ethyl 2-(2-{[6-(5-methyl-1H-pyrazol-1-yl)pyridazin-3-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C19 H19 N5 O3 S |
| Smiles: | CCOC(c1ccccc1NC(CSc1ccc(nn1)n1c(C)ccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5883 |
| logD: | 2.5718 |
| logSw: | -3.2608 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.939 |
| InChI Key: | OOOXPHOBFIGBBP-UHFFFAOYSA-N |