N-cyclooctyl-2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-cyclooctyl-2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)acetamide
N-cyclooctyl-2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | F680-0593 |
| Compound Name: | N-cyclooctyl-2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C26 H31 N3 O2 S |
| Smiles: | Cc1ccc(CN2C(C(=Nc3ccccc23)SCC(NC2CCCCCCC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4054 |
| logD: | 5.4054 |
| logSw: | -5.1967 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.125 |
| InChI Key: | DLWKOFOMKJBDCV-UHFFFAOYSA-N |