ethyl 2-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2029-0076 |
| Compound Name: | ethyl 2-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 575.6 |
| Molecular Formula: | C29 H25 N3 O8 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)OC)N2C(=NC=1C)SC(=C/c1ccc(c3ccc(cc3[N+]([O-])=O)OC)o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6922 |
| logD: | 5.6922 |
| logSw: | -5.5414 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 101.485 |
| InChI Key: | YURTYBXJHHXJBZ-AREMUKBSSA-N |