N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-[2-(4-methoxyphenyl)-2-oxoethylidene]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-[2-(4-methoxyphenyl)-2-oxoethylidene]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-[2-(4-methoxyphenyl)-2-oxoethylidene]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | C301-1527 |
| Compound Name: | N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-[2-(4-methoxyphenyl)-2-oxoethylidene]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 543.6 |
| Molecular Formula: | C30 H30 F N5 O4 |
| Smiles: | COc1ccc(cc1)C(/C=C1/C(Nc2cc(ccc2N1)C(NCCN1CCN(CC1)c1ccccc1F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.473 |
| logD: | 3.326 |
| logSw: | -3.8564 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.091 |
| InChI Key: | PKZGRULQWBETTD-UHFFFAOYSA-N |