5-[4-(azepan-1-yl)-4-oxobutyl]-3-methyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Chemical Structure Depiction of
5-[4-(azepan-1-yl)-4-oxobutyl]-3-methyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
5-[4-(azepan-1-yl)-4-oxobutyl]-3-methyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Compound characteristics
| Compound ID: | C884-2575 |
| Compound Name: | 5-[4-(azepan-1-yl)-4-oxobutyl]-3-methyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C21 H26 N4 O2 |
| Smiles: | CN1C(c2c(C=N1)c1ccccc1n2CCCC(N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.251 |
| logD: | 2.2506 |
| logSw: | -2.2649 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.724 |
| InChI Key: | PXVAVDDXXSKKHV-UHFFFAOYSA-N |