ethyl 2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4489-4920 |
| Compound Name: | ethyl 2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 610.04 |
| Molecular Formula: | C29 H24 Cl N3 O8 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OC)OC)N2C(=NC=1C)SC(=C/c1ccc(c3cc(ccc3[Cl])[N+]([O-])=O)o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8074 |
| logD: | 5.8074 |
| logSw: | -6.0284 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 101.96 |
| InChI Key: | IDUAZXKRCHZMHC-SANMLTNESA-N |