ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-methylphenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-methylphenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-methylphenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3270-0230 |
| Compound Name: | ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-methylphenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 670.23 |
| Molecular Formula: | C40 H32 Cl N3 O3 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)[Cl])N2C(=NC=1C)SC(=C/c1cc(c3ccccc3)n(c3ccc(C)cc3)c1c1ccccc1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 9.478 |
| logD: | 9.478 |
| logSw: | -6.4087 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.928 |
| InChI Key: | PSLWLYTXQHKYHM-QNGWXLTQSA-N |