N-[2-(4-chlorophenyl)ethyl]-2-({[(2-chlorophenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-({[(2-chlorophenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-[2-(4-chlorophenyl)ethyl]-2-({[(2-chlorophenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K781-9584 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-({[(2-chlorophenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 500.45 |
| Molecular Formula: | C25 H23 Cl2 N3 O2 S |
| Smiles: | C(CNC(c1ccc2c(c1)NC(C(CSCc1ccccc1[Cl])N2)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2939 |
| logD: | 5.2935 |
| logSw: | -5.9913 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 61.353 |
| InChI Key: | MZUYGKHFMGQGDH-QHCPKHFHSA-N |