4-(3,4-dihydroxyphenyl)-3-methyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
Chemical Structure Depiction of
4-(3,4-dihydroxyphenyl)-3-methyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
4-(3,4-dihydroxyphenyl)-3-methyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
Compound characteristics
| Compound ID: | D588-0191 |
| Compound Name: | 4-(3,4-dihydroxyphenyl)-3-methyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one |
| Molecular Weight: | 312.32 |
| Molecular Formula: | C17 H16 N2 O4 |
| Smiles: | Cc1c2C(C3=C(CCCC3=O)Nc2on1)c1ccc(c(c1)O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7454 |
| logD: | -0.0509 |
| logSw: | -2.2086 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.807 |
| InChI Key: | IIEDILMSNBTWKL-OAHLLOKOSA-N |