5-(4-tert-butylphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(4-tert-butylphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
5-(4-tert-butylphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4340-2867 |
| Compound Name: | 5-(4-tert-butylphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C24 H22 F N3 O3 S |
| Smiles: | Cc1nnc(N2C(C(=C(C2=O)O)C(c2ccc(cc2)F)=O)c2ccc(cc2)C(C)(C)C)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.664 |
| logD: | 4.6153 |
| logSw: | -4.3954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.341 |
| InChI Key: | XMKKQUALUFBOBK-LJQANCHMSA-N |