N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Compound characteristics
| Compound ID: | C880-2442 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide |
| Molecular Weight: | 484.49 |
| Molecular Formula: | C27 H21 F N4 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0407 |
| logD: | 4.0407 |
| logSw: | -4.335 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.659 |
| InChI Key: | BVRNYPUVMJBBOB-UHFFFAOYSA-N |