5-[(3-fluorophenyl)methyl]-7-methyl-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
Chemical Structure Depiction of
5-[(3-fluorophenyl)methyl]-7-methyl-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
5-[(3-fluorophenyl)methyl]-7-methyl-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
Compound characteristics
| Compound ID: | L152-0970 |
| Compound Name: | 5-[(3-fluorophenyl)methyl]-7-methyl-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide |
| Molecular Weight: | 462.53 |
| Molecular Formula: | C25 H27 F N6 O2 |
| Smiles: | Cc1ccc2c(c1)N(Cc1cccc(c1)F)C(c1nc(C(NCCCN3CCCC3)=O)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1165 |
| logD: | 0.084 |
| logSw: | -3.2083 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.227 |
| InChI Key: | HVEMZDYRBJKUCV-UHFFFAOYSA-N |