methyl [9-(3-methoxyphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Chemical Structure Depiction of
methyl [9-(3-methoxyphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
methyl [9-(3-methoxyphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Compound characteristics
| Compound ID: | D389-0184 |
| Compound Name: | methyl [9-(3-methoxyphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C19 H21 N5 O5 |
| Smiles: | CN1C(N(CC(=O)OC)C(c2c1nc1N(CCCn12)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9872 |
| logD: | 1.987 |
| logSw: | -2.4834 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.177 |
| InChI Key: | MAYATRRZWLRLJV-UHFFFAOYSA-N |