ethyl 5-(3-ethoxy-4-methoxyphenyl)-2-{[5-(4-methoxy-2-nitrophenyl)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-(3-ethoxy-4-methoxyphenyl)-2-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(3-ethoxy-4-methoxyphenyl)-2-{[5-(4-methoxy-2-nitrophenyl)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: | 4489-4230 |
| Compound Name: | ethyl 5-(3-ethoxy-4-methoxyphenyl)-2-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 619.65 |
| Molecular Formula: | C31 H29 N3 O9 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)OC)N2C(=NC=1C)SC(=C/c1ccc(c3ccc(cc3[N+]([O-])=O)OC)o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5181 |
| logD: | 5.5181 |
| logSw: | -5.5261 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 108.782 |
| InChI Key: | ICXKMSRJMBPJHQ-MUUNZHRXSA-N |