4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0151 |
| Compound Name: | 4-({8-methyl-2-[(4-methylphenyl)sulfanyl]quinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 526.61 |
| Molecular Formula: | C30 H26 N2 O5 S |
| Smiles: | Cc1ccc(cc1)Sc1c(\C=C2/C(=O)OC(c3cc(c(c(c3)OC)OC)OC)=N2)cc2cccc(C)c2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.6882 |
| logD: | 6.6882 |
| logSw: | -6.4347 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.315 |
| InChI Key: | OXTJYCLOPQWVQM-UHFFFAOYSA-N |