N-(butan-2-yl)-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide
N-(butan-2-yl)-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | F843-0649 |
| Compound Name: | N-(butan-2-yl)-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo[1,2,4]triazolo[4,3-a]quinoxalin-2(1H)-yl}acetamide |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C22 H23 N5 O3 S |
| Smiles: | CCC(C)NC(CN1C(N2C(C(=Nc3ccccc23)Sc2cccc(c2)OC)=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1463 |
| logD: | 3.1463 |
| logSw: | -3.5483 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.865 |
| InChI Key: | KKILFEWDYKHPDX-AWEZNQCLSA-N |