N-{2-[butyl(methyl)amino]ethyl}-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-{2-[butyl(methyl)amino]ethyl}-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamide
N-{2-[butyl(methyl)amino]ethyl}-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C463-0216 |
| Compound Name: | N-{2-[butyl(methyl)amino]ethyl}-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 361.5 |
| Molecular Formula: | C19 H27 N3 O2 S |
| Smiles: | CCCCN(C)CCNC(CSC1=CC(N(C)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8198 |
| logD: | 0.5566 |
| logSw: | -2.7449 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.042 |
| InChI Key: | XCWDDOXCNLQWFS-UHFFFAOYSA-N |