ethyl 7-methyl-2-[(2-methyl-1H-indol-3-yl)methylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-methyl-2-[(2-methyl-1H-indol-3-yl)methylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 7-methyl-2-[(2-methyl-1H-indol-3-yl)methylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3270-0290 |
| Compound Name: | ethyl 7-methyl-2-[(2-methyl-1H-indol-3-yl)methylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 503.64 |
| Molecular Formula: | C27 H25 N3 O3 S2 |
| Smiles: | CCOC(C1C(c2ccc(cc2)SC)N2C(=NC=1C)SC(=C/c1c3ccccc3[nH]c1C)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7004 |
| logD: | 5.7004 |
| logSw: | -5.7877 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.673 |
| InChI Key: | IRJWPCRNUXVIPN-XMMPIXPASA-N |