N-[2-(azepan-1-yl)ethyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide
N-[2-(azepan-1-yl)ethyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide
Compound characteristics
| Compound ID: | C890-0973 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide |
| Molecular Weight: | 449.6 |
| Molecular Formula: | C26 H35 N5 O2 |
| Smiles: | Cc1c2C=NN(C(c2c(C)n1CCCC(NCCN1CCCCCC1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9716 |
| logD: | 0.2728 |
| logSw: | -2.4619 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.113 |
| InChI Key: | CVVJXVLTRWJDOQ-UHFFFAOYSA-N |