prop-2-en-1-yl 2-[2-(2-fluorophenyl)-4-hydroxy-3-{3-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
prop-2-en-1-yl 2-[2-(2-fluorophenyl)-4-hydroxy-3-{3-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
prop-2-en-1-yl 2-[2-(2-fluorophenyl)-4-hydroxy-3-{3-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: | 4424-0567 |
| Compound Name: | prop-2-en-1-yl 2-[2-(2-fluorophenyl)-4-hydroxy-3-{3-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: | 548.59 |
| Molecular Formula: | C29 H25 F N2 O6 S |
| Smiles: | Cc1cc(ccc1OCC=C)C(C1C(c2ccccc2F)N(C(C=1O)=O)c1nc(C)c(C(=O)OCC=C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8817 |
| logD: | 5.7393 |
| logSw: | -5.6019 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.165 |
| InChI Key: | XXRRWHOGRMJNRN-HSZRJFAPSA-N |