ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-{[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-{[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-{[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8010-5194 |
| Compound Name: | ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-{[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 667.83 |
| Molecular Formula: | C40 H37 N5 O3 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)N(C)C)N2C(=NC=1C)SC(=C\c1ccc(cc1)N1C(CC(c3ccccc3)=N1)c1ccccc1)\C2=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.9667 |
| logD: | 7.9524 |
| logSw: | -5.8201 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.232 |
| InChI Key: | XMEIKZSEHDREEB-UHFFFAOYSA-N |