2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K977-0487 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 536.41 |
| Molecular Formula: | C24 H20 Cl2 F N3 O4 S |
| Smiles: | C(c1ccc(cc1)[Cl])NC(c1ccc2c(c1)NC(C(CS(Cc1ccc(cc1[Cl])F)(=O)=O)N2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0221 |
| logD: | 4.0217 |
| logSw: | -4.3895 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.811 |
| InChI Key: | PZROWQNELNDFKM-QFIPXVFZSA-N |