methyl (2Z)-5-(4-methoxyphenyl)-7-methyl-2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl (2Z)-5-(4-methoxyphenyl)-7-methyl-2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl (2Z)-5-(4-methoxyphenyl)-7-methyl-2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y070-1016 |
| Compound Name: | methyl (2Z)-5-(4-methoxyphenyl)-7-methyl-2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C27 H24 N2 O5 S |
| Smiles: | CC1C(=Cc2ccccc2O1)/C=C1/C(N2C(C(=C(C)N=C2S1)C(=O)OC)c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9765 |
| logD: | 4.9765 |
| logSw: | -4.7202 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.363 |
| InChI Key: | NABNXKGLTLQSHU-UHFFFAOYSA-N |