N-[(4-chlorophenyl)methyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-[(4-chlorophenyl)methyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K977-0119 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-{[(2-methylphenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 498 |
| Molecular Formula: | C25 H24 Cl N3 O4 S |
| Smiles: | Cc1ccccc1CS(CC1C(Nc2cc(ccc2N1)C(NCc1ccc(cc1)[Cl])=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9226 |
| logD: | 3.9222 |
| logSw: | -4.3566 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.811 |
| InChI Key: | AZRDEZPQLKRQLS-HSZRJFAPSA-N |