5-amino-7-(5-bromo-2,4-dimethoxyphenyl)-2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Chemical Structure Depiction of
5-amino-7-(5-bromo-2,4-dimethoxyphenyl)-2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
5-amino-7-(5-bromo-2,4-dimethoxyphenyl)-2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Compound characteristics
| Compound ID: | 2825-0036 |
| Compound Name: | 5-amino-7-(5-bromo-2,4-dimethoxyphenyl)-2-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile |
| Molecular Weight: | 660.34 |
| Molecular Formula: | C26 H20 Br2 N4 O5 S |
| Smiles: | COc1cc(c(cc1\C=C1/C(N2C(=C(C#N)C(C(C#N)=C2S1)c1cc(c(cc1OC)OC)[Br])N)=O)[Br])OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0159 |
| logD: | 5.0159 |
| logSw: | -4.8516 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.924 |
| InChI Key: | JYSRXHUOJRDNDV-QHCPKHFHSA-N |