N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | F844-0159 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[1-oxo-4-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl]acetamide |
| Molecular Weight: | 452.9 |
| Molecular Formula: | C22 H21 Cl N6 O3 |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N2C(C(=Nc3ccccc23)N2CCCC2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3509 |
| logD: | 3.3509 |
| logSw: | -3.5903 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.905 |
| InChI Key: | SBYFNNXIAVYVLO-UHFFFAOYSA-N |