7-bromo-3-[2-(4-cyclohexylphenyl)-2-oxoethylidene]-3,4-dihydropyrido[2,3-b]pyrazin-2(1H)-one
Chemical Structure Depiction of
7-bromo-3-[2-(4-cyclohexylphenyl)-2-oxoethylidene]-3,4-dihydropyrido[2,3-b]pyrazin-2(1H)-one
7-bromo-3-[2-(4-cyclohexylphenyl)-2-oxoethylidene]-3,4-dihydropyrido[2,3-b]pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | C301-0405 |
| Compound Name: | 7-bromo-3-[2-(4-cyclohexylphenyl)-2-oxoethylidene]-3,4-dihydropyrido[2,3-b]pyrazin-2(1H)-one |
| Molecular Weight: | 426.31 |
| Molecular Formula: | C21 H20 Br N3 O2 |
| Smiles: | C1CCC(CC1)c1ccc(cc1)C(/C=C1/C(Nc2cc(cnc2N1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1805 |
| logD: | 4.1882 |
| logSw: | -5.1872 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.985 |
| InChI Key: | JMNDCOXBLMQSMC-UHFFFAOYSA-N |