2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide
2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C880-0653 |
| Compound Name: | 2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-(3,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C27 H24 N4 O4 |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4109 |
| logD: | 4.4108 |
| logSw: | -4.3728 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.309 |
| InChI Key: | VWWBXGIMSKWXJN-UHFFFAOYSA-N |