7-(4-hydroxy-3-methoxyphenyl)-3-methyl-4-[4-(methylsulfanyl)phenyl]-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
Chemical Structure Depiction of
7-(4-hydroxy-3-methoxyphenyl)-3-methyl-4-[4-(methylsulfanyl)phenyl]-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
7-(4-hydroxy-3-methoxyphenyl)-3-methyl-4-[4-(methylsulfanyl)phenyl]-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
Compound characteristics
| Compound ID: | D526-0273 |
| Compound Name: | 7-(4-hydroxy-3-methoxyphenyl)-3-methyl-4-[4-(methylsulfanyl)phenyl]-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C25 H24 N2 O4 S |
| Smiles: | Cc1c2C(C3=C(CC(CC3=O)c3ccc(c(c3)OC)O)Nc2on1)c1ccc(cc1)SC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4009 |
| logD: | 2.0252 |
| logSw: | -4.0708 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.618 |
| InChI Key: | ITOCUDZKPBQEBU-UHFFFAOYSA-N |