1-acetyl-5-{[8-methyl-2-(piperidin-1-yl)quinolin-3-yl]methylidene}-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
1-acetyl-5-{[8-methyl-2-(piperidin-1-yl)quinolin-3-yl]methylidene}-2-sulfanylideneimidazolidin-4-one
1-acetyl-5-{[8-methyl-2-(piperidin-1-yl)quinolin-3-yl]methylidene}-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 4261-0193 |
| Compound Name: | 1-acetyl-5-{[8-methyl-2-(piperidin-1-yl)quinolin-3-yl]methylidene}-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | CC(N1C(=C/c2cc3cccc(C)c3nc2N2CCCCC2)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.66 |
| logD: | 0.4691 |
| logSw: | -3.889 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.782 |
| InChI Key: | VNAIYVZSVABMCW-UHFFFAOYSA-N |