N-(3-acetylphenyl)-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
N-(3-acetylphenyl)-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | C880-0696 |
| Compound Name: | N-(3-acetylphenyl)-2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide |
| Molecular Weight: | 450.5 |
| Molecular Formula: | C27 H22 N4 O3 |
| Smiles: | CC(c1cccc(c1)NC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0127 |
| logD: | 4.0127 |
| logSw: | -4.2006 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.048 |
| InChI Key: | GJVLHATZUKKBIQ-UHFFFAOYSA-N |