3-({[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methyl}sulfanyl)quinoxalin-2(1H)-one
Chemical Structure Depiction of
3-({[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methyl}sulfanyl)quinoxalin-2(1H)-one
3-({[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methyl}sulfanyl)quinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 8018-3775 |
| Compound Name: | 3-({[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methyl}sulfanyl)quinoxalin-2(1H)-one |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | CC(C)c1cc(CSC2C(Nc3ccccc3N=2)=O)c(C)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.5704 |
| logD: | 4.5704 |
| logSw: | -4.3137 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.003 |
| InChI Key: | QMKHYBWWXILORA-UHFFFAOYSA-N |