ethyl 4-{2,5-dioxo-3-[(pyrimidin-2-yl)sulfanyl]pyrrolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{2,5-dioxo-3-[(pyrimidin-2-yl)sulfanyl]pyrrolidin-1-yl}benzoate
ethyl 4-{2,5-dioxo-3-[(pyrimidin-2-yl)sulfanyl]pyrrolidin-1-yl}benzoate
Compound characteristics
Compound ID: | Y020-0541 |
Compound Name: | ethyl 4-{2,5-dioxo-3-[(pyrimidin-2-yl)sulfanyl]pyrrolidin-1-yl}benzoate |
Molecular Weight: | 357.39 |
Molecular Formula: | C17 H15 N3 O4 S |
Smiles: | CCOC(c1ccc(cc1)N1C(CC(C1=O)Sc1ncccn1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.6235 |
logD: | 1.6225 |
logSw: | -2.3539 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 68.069 |
InChI Key: | IGYXCTGHILDOMQ-ZDUSSCGKSA-N |