2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[3-(pyrrolidin-1-yl)propyl]acetamide
2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | F680-0703 |
| Compound Name: | 2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[3-(pyrrolidin-1-yl)propyl]acetamide |
| Molecular Weight: | 450.6 |
| Molecular Formula: | C25 H30 N4 O2 S |
| Smiles: | Cc1ccc(CN2C(C(=Nc3ccccc23)SCC(NCCCN2CCCC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9783 |
| logD: | -0.1122 |
| logSw: | -3.2971 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.259 |
| InChI Key: | ZTRUNCWCEGUKLM-UHFFFAOYSA-N |