3-[(3-hexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(4-methoxyphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-hexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(4-methoxyphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-hexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(4-methoxyphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | Y070-2008 |
| Compound Name: | 3-[(3-hexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(4-methoxyphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C25 H25 N3 O4 S2 |
| Smiles: | CCCCCCN1C(/C(=C/C2=C(N=C3C=CC=CN3C2=O)Oc2ccc(cc2)OC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3766 |
| logD: | 5.3766 |
| logSw: | -5.221 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 56.74 |
| InChI Key: | QKOUSIUAWGEVBC-UHFFFAOYSA-N |