N-[(3-methoxyphenyl)methyl]-4-(4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-4-(4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
N-[(3-methoxyphenyl)methyl]-4-(4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
Compound characteristics
| Compound ID: | C884-2434 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-4-(4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C22 H22 N4 O3 |
| Smiles: | COc1cccc(CNC(CCCn2c3C(NN=Cc3c3ccccc23)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7521 |
| logD: | 2.7519 |
| logSw: | -3.1807 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.075 |
| InChI Key: | DNAYORDTPKTCHA-UHFFFAOYSA-N |