ethyl 4-methyl-2-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido]-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-methyl-2-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido]-1,3-thiazole-5-carboxylate
ethyl 4-methyl-2-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido]-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | J102-0209 |
| Compound Name: | ethyl 4-methyl-2-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido]-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C18 H22 N4 O4 S |
| Smiles: | CCOC(c1c(C)nc(NC(CN2C(C=C3CCCCCC3=N2)=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7471 |
| logD: | 2.7247 |
| logSw: | -3.0292 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.09 |
| InChI Key: | XESVKIUYEVMWGK-UHFFFAOYSA-N |