ethyl 2-[2-(3-chlorophenyl)-4-hydroxy-3-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(3-chlorophenyl)-4-hydroxy-3-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-[2-(3-chlorophenyl)-4-hydroxy-3-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4424-1133 |
| Compound Name: | ethyl 2-[2-(3-chlorophenyl)-4-hydroxy-3-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 553.03 |
| Molecular Formula: | C28 H25 Cl N2 O6 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C(=C(C2=O)O)C(c2ccc(cc2C)OCC=C)=O)c2cccc(c2)[Cl])s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9633 |
| logD: | 5.8683 |
| logSw: | -5.7125 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.784 |
| InChI Key: | JYCUKPBWJZSVNC-JOCHJYFZSA-N |