2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(2,4-dimethoxyphenyl)acetamide
2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C880-0652 |
| Compound Name: | 2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C27 H24 N4 O4 |
| Smiles: | COc1ccc(c(c1)OC)NC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.017 |
| logD: | 4.017 |
| logSw: | -4.3061 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.697 |
| InChI Key: | KHUIJSZFGMPOKU-UHFFFAOYSA-N |