2-[2-(azepan-1-yl)-2-oxoethyl]-6-[(2-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Chemical Structure Depiction of
2-[2-(azepan-1-yl)-2-oxoethyl]-6-[(2-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
2-[2-(azepan-1-yl)-2-oxoethyl]-6-[(2-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Compound characteristics
| Compound ID: | C891-1783 |
| Compound Name: | 2-[2-(azepan-1-yl)-2-oxoethyl]-6-[(2-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C23 H27 F N4 O2 |
| Smiles: | Cc1c2C=NN(CC(N3CCCCCC3)=O)C(c2c(C)n1Cc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9261 |
| logD: | 2.9261 |
| logSw: | -3.0031 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.651 |
| InChI Key: | UVTIRILSZNLKLD-UHFFFAOYSA-N |