2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | M043-1055 |
| Compound Name: | 2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 493.53 |
| Molecular Formula: | C21 H20 F N3 O6 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CSc1ccc(nn1)S(c1cccc(c1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3999 |
| logD: | 2.3995 |
| logSw: | -3.0657 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.474 |
| InChI Key: | MBBLSAGYQXBOQG-UHFFFAOYSA-N |