2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | F680-0713 |
| Compound Name: | 2-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}sulfanyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 465.62 |
| Molecular Formula: | C25 H31 N5 O2 S |
| Smiles: | Cc1ccc(CN2C(C(=Nc3ccccc23)SCC(NCCN2CCN(C)CC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0257 |
| logD: | 1.3583 |
| logSw: | -2.5096 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.37 |
| InChI Key: | LQIPJSWOCUOBAX-UHFFFAOYSA-N |