N-benzyl-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
N-benzyl-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Compound characteristics
| Compound ID: | G741-0406 |
| Compound Name: | N-benzyl-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C26 H26 N4 O3 S |
| Smiles: | CSc1ccc(CNC(CN2C(CN(C(NCc3ccccc3)=O)c3ccccc23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3422 |
| logD: | 3.3422 |
| logSw: | -3.7048 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.559 |
| InChI Key: | YUJGARONSWSGEI-UHFFFAOYSA-N |