ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y509-0874 |
| Compound Name: | ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 485.28 |
| Molecular Formula: | C18 H20 I N3 O5 |
| Smiles: | CCOC(C1C(c2cc(c(c(c2)I)OCC#N)OCC)NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1502 |
| logD: | 2 |
| logSw: | -2.8523 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.738 |
| InChI Key: | OHBCNQVUGPEUGT-HNNXBMFYSA-N |