6-acetyl-2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Chemical Structure Depiction of
6-acetyl-2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
6-acetyl-2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Compound characteristics
| Compound ID: | 8009-8546 |
| Compound Name: | 6-acetyl-2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one |
| Molecular Weight: | 626.47 |
| Molecular Formula: | C28 H23 I N2 O5 S |
| Smiles: | CC1=C(C(c2c(ccc3ccccc23)OC)N2C(=N1)SC(=C\c1cc(c(c(c1)I)O)OC)\C2=O)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.347 |
| logD: | 5.2669 |
| logSw: | -6.3031 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.289 |
| InChI Key: | KDRLRRVSTMZKRF-VWLOTQADSA-N |