ethyl 5-(2-bromo-4,5-dimethoxyphenyl)-2-{[5-(2-cyanophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(2-bromo-4,5-dimethoxyphenyl)-2-{[5-(2-cyanophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(2-bromo-4,5-dimethoxyphenyl)-2-{[5-(2-cyanophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4281-1354 |
| Compound Name: | ethyl 5-(2-bromo-4,5-dimethoxyphenyl)-2-{[5-(2-cyanophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 634.51 |
| Molecular Formula: | C30 H24 Br N3 O6 S |
| Smiles: | CCOC(C1C(c2cc(c(cc2[Br])OC)OC)N2C(=NC=1C)SC(=C\c1ccc(c3ccccc3C#N)o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2088 |
| logD: | 5.2088 |
| logSw: | -5.0776 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.634 |
| InChI Key: | UJXYBOIIQXPZRK-MHZLTWQESA-N |