7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3,4-dihydroquinoxalin-2(1H)-one
7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | K781-9867 |
| Compound Name: | 7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-({[(2-methylphenyl)methyl]sulfanyl}methyl)-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 504.63 |
| Molecular Formula: | C28 H29 F N4 O2 S |
| Smiles: | Cc1ccccc1CSCC1C(Nc2cc(ccc2N1)C(N1CCN(CC1)c1ccccc1F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0519 |
| logD: | 5.0519 |
| logSw: | -4.6511 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.705 |
| InChI Key: | QFFVUBYVOKSJCQ-VWLOTQADSA-N |