ethyl 4-amino-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]pyrimidine-5-carboxylate
ethyl 4-amino-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]pyrimidine-5-carboxylate
Compound characteristics
Compound ID: | Y020-6925 |
Compound Name: | ethyl 4-amino-2-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]pyrimidine-5-carboxylate |
Molecular Weight: | 327.36 |
Molecular Formula: | C13 H17 N3 O5 S |
Smiles: | CCOC(CC(CSc1ncc(C(=O)OCC)c(N)n1)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.068 |
logD: | 1.068 |
logSw: | -2.0159 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 92.418 |
InChI Key: | HTARQTYEBUSCTQ-UHFFFAOYSA-N |