ethyl 5-(3-bromo-4-methoxyphenyl)-7-methyl-3-oxo-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-bromo-4-methoxyphenyl)-7-methyl-3-oxo-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(3-bromo-4-methoxyphenyl)-7-methyl-3-oxo-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4489-4171 |
| Compound Name: | ethyl 5-(3-bromo-4-methoxyphenyl)-7-methyl-3-oxo-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 647.47 |
| Molecular Formula: | C29 H22 Br F3 N2 O5 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)[Br])OC)N2C(=NC=1C)SC(=C/c1ccc(c3cccc(c3)C(F)(F)F)o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9227 |
| logD: | 6.9227 |
| logSw: | -5.8685 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.948 |
| InChI Key: | OPEKQFNRRSQBIH-VWLOTQADSA-N |