ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)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 (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)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: | 3202-0250 |
| Compound Name: | ethyl (2E)-2-[(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 626.77 |
| Molecular Formula: | C36 H38 N2 O6 S |
| Smiles: | CCC(C)c1ccc(cc1)OCCOc1ccc(\C=C2/C(N3C(C(=C(C)N=C3S2)C(=O)OCC)c2ccc(cc2)OC)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.8576 |
| logD: | 7.8576 |
| logSw: | -5.7382 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.855 |
| InChI Key: | IPGNIGZWWIMFGR-UHFFFAOYSA-N |