4-({2-[(4-chlorophenyl)sulfanyl]-7-methylquinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-({2-[(4-chlorophenyl)sulfanyl]-7-methylquinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-({2-[(4-chlorophenyl)sulfanyl]-7-methylquinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0215 |
| Compound Name: | 4-({2-[(4-chlorophenyl)sulfanyl]-7-methylquinolin-3-yl}methylidene)-2-(3,4-dimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 517 |
| Molecular Formula: | C28 H21 Cl N2 O4 S |
| Smiles: | Cc1ccc2cc(\C=C3/C(=O)OC(c4ccc(c(c4)OC)OC)=N3)c(nc2c1)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.8593 |
| logD: | 6.8593 |
| logSw: | -6.5116 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.827 |
| InChI Key: | INALQWOQKDBLCR-UHFFFAOYSA-N |