ethyl 2-{[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)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 2-{[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-{[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)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: | 3871-0594 |
| Compound Name: | ethyl 2-{[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 520.6 |
| Molecular Formula: | C28 H28 N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)OC)N2C(=NC=1C)SC(=C\c1cc(CC=C)c(c(c1)OC)O)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9424 |
| logD: | 4.9413 |
| logSw: | -4.5482 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.401 |
| InChI Key: | QOOUHZZTYHVLBR-XMMPIXPASA-N |