N-(4-methylphenyl)-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
N-(4-methylphenyl)-4-[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Compound characteristics
| Compound ID: | G741-1125 |
| Compound Name: | N-(4-methylphenyl)-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: | Cc1ccc(cc1)NC(N1CC(N(CC(NCc2ccc(cc2)SC)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1565 |
| logD: | 4.1565 |
| logSw: | -4.1553 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.237 |
| InChI Key: | VVPNYEPDOFLASN-UHFFFAOYSA-N |