5-(4-tert-butylphenyl)-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(4-tert-butylphenyl)-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
5-(4-tert-butylphenyl)-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
Compound ID: | Y070-4926 |
Compound Name: | 5-(4-tert-butylphenyl)-3-hydroxy-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-1-(1,3-thiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
Molecular Weight: | 474.58 |
Molecular Formula: | C27 H26 N2 O4 S |
Smiles: | CC1Cc2cc(ccc2O1)C(C1C(c2ccc(cc2)C(C)(C)C)N(C(C=1O)=O)c1nccs1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.6314 |
logD: | 5.489 |
logSw: | -5.403 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.869 |
InChI Key: | JPTIBPJAVQXKAX-UHFFFAOYSA-N |