2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K784-7093 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 551.08 |
| Molecular Formula: | C26 H32 Cl F N4 O4 S |
| Smiles: | CC1CCCCN1CCCNC(c1ccc2c(c1)NC(C(CS(Cc1ccc(cc1[Cl])F)(=O)=O)N2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.883 |
| logD: | 0.0346 |
| logSw: | -3.7005 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.086 |
| InChI Key: | YKLONMVNALBYFO-UHFFFAOYSA-N |