2-[(benzylsulfanyl)methyl]-6-methylquinolin-4(1H)-one
Chemical Structure Depiction of
2-[(benzylsulfanyl)methyl]-6-methylquinolin-4(1H)-one
2-[(benzylsulfanyl)methyl]-6-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | G751-0529 |
| Compound Name: | 2-[(benzylsulfanyl)methyl]-6-methylquinolin-4(1H)-one |
| Molecular Weight: | 295.4 |
| Molecular Formula: | C18 H17 N O S |
| Smiles: | Cc1ccc2c(c1)C(C=C(CSCc1ccccc1)N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5134 |
| logD: | 4.4592 |
| logSw: | -4.3478 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.7616 |
| InChI Key: | WJULCZJKFHUFDL-UHFFFAOYSA-N |