ethyl 2-(3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-(3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4424-0558 |
| Compound Name: | ethyl 2-(3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-2,5-dihydro-1H-pyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 574.65 |
| Molecular Formula: | C31 H30 N2 O7 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C(=C(C2=O)O)C(c2ccc(c(C)c2)OCC=C)=O)c2ccc(cc2)OCC=C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2239 |
| logD: | 6.0815 |
| logSw: | -5.4992 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.288 |
| InChI Key: | VAPMJTSSWBEJHV-RUZDIDTESA-N |