3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-5-(4-phenyl-1,3-thiazol-2-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-5-(4-phenyl-1,3-thiazol-2-yl)pyrimidin-4(3H)-one
3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-5-(4-phenyl-1,3-thiazol-2-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | P492-0897 |
| Compound Name: | 3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-5-(4-phenyl-1,3-thiazol-2-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C24 H20 N4 O2 S |
| Smiles: | C1CN(Cc2ccccc12)C(CN1C=NC=C(C1=O)c1nc(cs1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.397 |
| logD: | 3.3967 |
| logSw: | -3.4904 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.392 |
| InChI Key: | PRHGSAKDRSESAK-UHFFFAOYSA-N |