2-(3,4-dihydroisoquinolin-2(1H)-yl)-9-methyl-3-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinolin-2(1H)-yl)-9-methyl-3-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-9-methyl-3-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | Y070-2411 |
| Compound Name: | 2-(3,4-dihydroisoquinolin-2(1H)-yl)-9-methyl-3-[(4-oxo-3-propyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Smiles: | CCCN1C(/C(=C/C2=C(N=C3C(C)=CC=CN3C2=O)N2CCc3ccccc3C2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2858 |
| logD: | 4.2858 |
| logSw: | -4.1557 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.168 |
| InChI Key: | YNJPXKDSNGATJZ-UHFFFAOYSA-N |