ethyl 5-(3-methoxyphenyl)-3-oxo-7-phenyl-2-({4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-methoxyphenyl)-3-oxo-7-phenyl-2-({4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(3-methoxyphenyl)-3-oxo-7-phenyl-2-({4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3969-1823 |
| Compound Name: | ethyl 5-(3-methoxyphenyl)-3-oxo-7-phenyl-2-({4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 550.63 |
| Molecular Formula: | C32 H26 N2 O5 S |
| Smiles: | CCOC(C1C(c2cccc(c2)OC)N2C(=NC=1c1ccccc1)SC(=C/c1ccc(cc1)OCC#C)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2293 |
| logD: | 6.2293 |
| logSw: | -5.5675 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.938 |
| InChI Key: | LEYDGIZTYRPUAD-GDLZYMKVSA-N |