2-(3,4-dimethoxyphenyl)-4-{[2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-4-{[2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one
2-(3,4-dimethoxyphenyl)-4-{[2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5141-0199 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-4-{[2-(phenylsulfanyl)quinolin-3-yl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C27 H20 N2 O4 S |
| Smiles: | COc1ccc(cc1OC)C1=NC(=C\c2cc3ccccc3nc2Sc2ccccc2)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 5.5287 |
| logD: | 5.5287 |
| logSw: | -6.1583 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.827 |
| InChI Key: | GPCDNSOYFRHGHE-UHFFFAOYSA-N |