ethyl 5-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-7-methyl-3-oxo-2-[(pyridin-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-7-methyl-3-oxo-2-[(pyridin-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-7-methyl-3-oxo-2-[(pyridin-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3971-0659 |
| Compound Name: | ethyl 5-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-7-methyl-3-oxo-2-[(pyridin-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 505.59 |
| Molecular Formula: | C27 H27 N3 O5 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)OCC=C)N2C(=NC=1C)SC(=C\c1ccccn1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8947 |
| logD: | 3.8947 |
| logSw: | -3.8962 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.005 |
| InChI Key: | XKMPZCWXQZSHEM-XMMPIXPASA-N |