ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-benzylidene-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-benzylidene-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-benzylidene-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4137-1073 |
| Compound Name: | ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-benzylidene-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 510.57 |
| Molecular Formula: | C29 H22 N2 O5 S |
| Smiles: | CCOC(C1C(c2ccc3c(c2)OCO3)N2C(=NC=1c1ccccc1)SC(=C/c1ccccc1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0949 |
| logD: | 6.0948 |
| logSw: | -5.5382 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.092 |
| InChI Key: | DJEICCSJYYTCQF-AREMUKBSSA-N |