1-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinoxalin-2(1H)-one
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinoxalin-2(1H)-one
1-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | F680-0615 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinoxalin-2(1H)-one |
| Molecular Weight: | 484.62 |
| Molecular Formula: | C28 H28 N4 O2 S |
| Smiles: | Cc1ccc(CN2C(C(=Nc3ccccc23)SCC(N2CCN(CC2)c2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4158 |
| logD: | 4.4157 |
| logSw: | -4.2047 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.25 |
| InChI Key: | KLLZVUJFLFYAJR-UHFFFAOYSA-N |