ethyl 2-{[4-(benzyloxy)-3-iodo-5-methoxyphenyl]methylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[4-(benzyloxy)-3-iodo-5-methoxyphenyl]methylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-{[4-(benzyloxy)-3-iodo-5-methoxyphenyl]methylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3270-0440 |
| Compound Name: | ethyl 2-{[4-(benzyloxy)-3-iodo-5-methoxyphenyl]methylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 666.53 |
| Molecular Formula: | C31 H27 I N2 O5 S |
| Smiles: | CCOC(C1C(c2ccccc2)N2C(=NC=1C)SC(=C/c1cc(c(c(c1)I)OCc1ccccc1)OC)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8169 |
| logD: | 6.8169 |
| logSw: | -5.6601 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.779 |
| InChI Key: | JMQYJQKVMQVBRJ-MHZLTWQESA-N |