ethyl 2-(3-hydroxy-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-hydroxy-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-(3-hydroxy-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4424-1136 |
| Compound Name: | ethyl 2-(3-hydroxy-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 560.67 |
| Molecular Formula: | C31 H32 N2 O6 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C(=C(C2=O)O)C(c2ccc(cc2C)OCC=C)=O)c2ccc(cc2)C(C)C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6985 |
| logD: | 6.6036 |
| logSw: | -5.6644 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.784 |
| InChI Key: | LOLVDACRJBULKH-RUZDIDTESA-N |