prop-2-en-1-yl 2-[3-hydroxy-5-(4-methylphenyl)-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-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-[3-hydroxy-5-(4-methylphenyl)-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
prop-2-en-1-yl 2-[3-hydroxy-5-(4-methylphenyl)-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4424-1143 |
| Compound Name: | prop-2-en-1-yl 2-[3-hydroxy-5-(4-methylphenyl)-4-{2-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 544.63 |
| Molecular Formula: | C30 H28 N2 O6 S |
| Smiles: | Cc1ccc(cc1)C1C(=C(C(N1c1nc(C)c(C(=O)OCC=C)s1)=O)O)C(c1ccc(cc1C)OCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7881 |
| logD: | 5.6932 |
| logSw: | -5.4516 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.078 |
| InChI Key: | DUCIHIXAEGZUFJ-XMMPIXPASA-N |