7-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
7-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
7-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | P516-0624 |
| Compound Name: | 7-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C19 H17 N5 O2 S |
| Smiles: | Cc1ccc2c(c1)NC(c1c(C(NCc3ccc(cc3)SC)=O)nnn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7063 |
| logD: | 2.6872 |
| logSw: | -3.1757 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.671 |
| InChI Key: | FMPXAQLIWJXCRV-UHFFFAOYSA-N |