4-(4-chlorobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(4-chlorobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
4-(4-chlorobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
Compound ID: | 4340-2789 |
Compound Name: | 4-(4-chlorobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
Molecular Weight: | 471.92 |
Molecular Formula: | C22 H18 Cl N3 O5 S |
Smiles: | Cc1nnc(N2C(C(=C(C2=O)O)C(c2ccc(cc2)[Cl])=O)c2ccc(c(c2)OC)OC)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0978 |
logD: | 3.0491 |
logSw: | -3.5189 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.602 |
InChI Key: | IAXFKUNNBXKVTR-GOSISDBHSA-N |