2-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-phenylpiperazin-1-yl)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-phenylpiperazin-1-yl)pyridazin-3(2H)-one
2-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-phenylpiperazin-1-yl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F046-0146 |
| Compound Name: | 2-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-phenylpiperazin-1-yl)pyridazin-3(2H)-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C22 H29 N5 O2 |
| Smiles: | C1CCCN(CC1)C(CN1C(C=CC(=N1)N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2241 |
| logD: | 2.224 |
| logSw: | -2.4035 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.108 |
| InChI Key: | RSPYAYYGPRPYOE-UHFFFAOYSA-N |