ethyl 2-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3270-0277 |
| Compound Name: | ethyl 2-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 572.54 |
| Molecular Formula: | C26 H26 Br N3 O3 S2 |
| Smiles: | CCOC(C1C(c2ccc(cc2)SC)N2C(=NC=1C)SC(=C/c1ccc(c(c1)[Br])N(C)C)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8989 |
| logD: | 5.8989 |
| logSw: | -5.5044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.251 |
| InChI Key: | NUHOBJYWIHZHSF-QHCPKHFHSA-N |