4-({2-[(4-chlorophenyl)sulfanyl]-8-methylquinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-({2-[(4-chlorophenyl)sulfanyl]-8-methylquinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-({2-[(4-chlorophenyl)sulfanyl]-8-methylquinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0152 |
| Compound Name: | 4-({2-[(4-chlorophenyl)sulfanyl]-8-methylquinolin-3-yl}methylidene)-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 547.03 |
| Molecular Formula: | C29 H23 Cl N2 O5 S |
| Smiles: | Cc1cccc2cc(\C=C3/C(=O)OC(c4cc(c(c(c4)OC)OC)OC)=N3)c(nc12)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.8596 |
| logD: | 6.8596 |
| logSw: | -6.6837 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.315 |
| InChI Key: | YOGAOEBOEWLLRV-UHFFFAOYSA-N |