3-(2,4-dimethoxyphenyl)-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
3-(2,4-dimethoxyphenyl)-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-(2,4-dimethoxyphenyl)-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C258-0497 |
| Compound Name: | 3-(2,4-dimethoxyphenyl)-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 516.58 |
| Molecular Formula: | C27 H24 N4 O5 S |
| Smiles: | CC1=CC=CC2=NC(CN3C(N(C(c4c5CCCc5sc34)=O)c3ccc(cc3OC)OC)=O)=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.425 |
| logD: | 3.425 |
| logSw: | -4.1314 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.918 |
| InChI Key: | YHUNSAJYTKPPBW-UHFFFAOYSA-N |