N-[(3-chloro-4-fluorophenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | P516-0212 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 371.76 |
| Molecular Formula: | C17 H11 Cl F N5 O2 |
| Smiles: | C(c1ccc(c(c1)[Cl])F)NC(c1c2C(Nc3ccccc3n2nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2657 |
| logD: | 2.237 |
| logSw: | -3.3348 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.671 |
| InChI Key: | PFTFVULEMDKQHF-UHFFFAOYSA-N |