5-(3-ethoxy-4-hydroxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(3-ethoxy-4-hydroxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
5-(3-ethoxy-4-hydroxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
Compound ID: | 4476-4530 |
Compound Name: | 5-(3-ethoxy-4-hydroxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
Molecular Weight: | 441.44 |
Molecular Formula: | C21 H16 F N3 O5 S |
Smiles: | CCOc1cc(ccc1O)C1C(=C(C(N1c1nncs1)=O)O)C(c1ccc(cc1)F)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.5405 |
logD: | 2.4917 |
logSw: | -2.7667 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.323 |
InChI Key: | OQCJTNWVCDFNLX-QGZVFWFLSA-N |