5-{3-[2-(azepan-1-yl)-2-oxoethyl]piperidin-1-yl}-2-ethylpyridazin-3(2H)-one
Chemical Structure Depiction of
5-{3-[2-(azepan-1-yl)-2-oxoethyl]piperidin-1-yl}-2-ethylpyridazin-3(2H)-one
5-{3-[2-(azepan-1-yl)-2-oxoethyl]piperidin-1-yl}-2-ethylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | S396-0498 |
| Compound Name: | 5-{3-[2-(azepan-1-yl)-2-oxoethyl]piperidin-1-yl}-2-ethylpyridazin-3(2H)-one |
| Molecular Weight: | 346.47 |
| Molecular Formula: | C19 H30 N4 O2 |
| Smiles: | CCN1C(C=C(C=N1)N1CCCC(CC(N2CCCCCC2)=O)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0377 |
| logD: | 1.9449 |
| logSw: | -2.0367 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.875 |
| InChI Key: | KUQUFBZGMMGAEX-MRXNPFEDSA-N |