2-[(benzylsulfanyl)methyl]-6-chloroquinolin-4(1H)-one
Chemical Structure Depiction of
2-[(benzylsulfanyl)methyl]-6-chloroquinolin-4(1H)-one
2-[(benzylsulfanyl)methyl]-6-chloroquinolin-4(1H)-one
Compound characteristics
| Compound ID: | G751-1869 |
| Compound Name: | 2-[(benzylsulfanyl)methyl]-6-chloroquinolin-4(1H)-one |
| Molecular Weight: | 315.82 |
| Molecular Formula: | C17 H14 Cl N O S |
| Smiles: | C(C1=CC(c2cc(ccc2N1)[Cl])=O)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7877 |
| logD: | 3.9245 |
| logSw: | -5.0123 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.7616 |
| InChI Key: | BBBJDWKTEVQDOT-UHFFFAOYSA-N |