N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
Compound characteristics
| Compound ID: | F249-0188 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide |
| Molecular Weight: | 483.36 |
| Molecular Formula: | C23 H23 Br N4 O3 |
| Smiles: | CN1C(c2c(C=N1)c1ccccc1n2CCCC(NCc1cc(ccc1OC)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.943 |
| logD: | 2.9425 |
| logSw: | -3.3116 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.103 |
| InChI Key: | AUAABIWKPMAWHK-UHFFFAOYSA-N |