2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-N-[3-(piperidin-1-yl)propyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-N-[3-(piperidin-1-yl)propyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-N-[3-(piperidin-1-yl)propyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K784-7102 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-N-[3-(piperidin-1-yl)propyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 537.05 |
| Molecular Formula: | C25 H30 Cl F N4 O4 S |
| Smiles: | C1CCN(CC1)CCCNC(c1ccc2c(c1)NC(C(CS(Cc1ccc(cc1[Cl])F)(=O)=O)N2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7298 |
| logD: | 0.1336 |
| logSw: | -3.6612 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.635 |
| InChI Key: | ONUGEHBYLSCHNX-QHCPKHFHSA-N |